SCHEMBL5311708

SCHEMBL5311708

O=C([O-])CCCOc1ccc(Cl)cc1Cl.[Na+]

nearest known ligand 0.67

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
HPGD P15428 8/20 0.62
RAB9A P51151 4/20 0.62
NPC1 O15118 3/20 0.62
TSHR P16473 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
NLRP1 Q9C000 1/20 0.60
MAPK1 P28482 2/20 0.59
TP53 P04637 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
CYP3A4 P08684 1/20 0.58
GAA P10253 1/20 0.58
ALDH1A1 P00352 3/20 0.56
LMNA P02545 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
HTT P42858 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Potassium Ion SCHEMBL1890648 0.97 MAPT (0.67) MAPTHPGDRAB9ANPC1TSHR
SCHEMBL8441616 0.92 MAPT (0.60) MAPTHPGDRAB9ANPC1TSHR
Potassium Ion SCHEMBL8438890 0.89 MAPT (0.60) MAPTHPGDRAB9ANPC1TSHR
SCHEMBL29364868 0.85 RAB9A (0.78) MAPTHPGDRAB9ANPC1TSHR
SCHEMBL116448 0.85 RAB9A (0.78) MAPTHPGDRAB9ANPC1TSHR
Mcpb SCHEMBL15547896 0.85 KDM4E (0.68) MAPTHPGDRAB9ANPC1SMN1; SMN2
SCHEMBL11002763 0.84 MAPT (0.70) MAPTHPGDRAB9ANPC1TSHR
Hydrochloric Acid SCHEMBL11002766 0.84 RAB9A (0.76) MAPTHPGDRAB9ANPC1TSHR
SCHEMBL12522764 0.84 MAPT (0.70) MAPTHPGDRAB9ANPC1TSHR
SCHEMBL8389330 0.83 MAPT (0.73) MAPTHPGDRAB9ANPC1TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 233 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3060043-B1 PESTICIDAL COMPOSITIONS AND RELATED METHODS CORTEVA AGRISCIENCE LLC (US) 2025-11-26 EP claimed
EP-4337017-A1 HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS Bayer Aktiengesellschaft (DE) 2024-03-20 EP claimed
US-20240043859-A1 HERBICIDE-RESISTANT PROTEIN, AND GENE AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2024-02-08 US claimed
US-20230000079-A1 COMBINATION COMPRISING A TRIKETONE HERBICIDE AND A DIPHENYLETHER HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION Generic Crop Science LLC (US) 2023-01-05 US claimed
WO-2022152728-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2022-07-21 WO claimed
US-20260144252-A1 BROMINE- OR IODINE-PARA-SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND THEIR SALTS, AGENTS FOR PROTECTING USEFUL PLANTS OR CROP PLANTS COMPRISING THEM, METHODS FOR PRODUCING THEM AND THEIR USE AS SAFENERS BAYER AKTIENGESELLSCHAFT (DE) 2026-05-28 US disclosed
US-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2026-05-21 US disclosed
US-12604894-B2 Solid pesticidal formulation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2026-04-21 US disclosed
US-12568967-B2 Compositions comprising pyridine carboxylate herbicides with synthetic auxin herbicides or auxin transport inhibitors CORTEVA AGRISCIENCE LLC (US) 2026-03-10 US disclosed
US-20260047579-A1 METHOD OF CONTROLLING WEEDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2026-02-19 US disclosed
US-20260042731-A1 (2,4-DICHLOROPHENOXY)ACETIC ACID ANALOGS CORTEVA AGRISCIENCE LLC (US) 2026-02-12 US disclosed
US-12543737-B2 Herbicidal composition and method for controlling weeds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2026-02-10 US disclosed
EP-3890489-A1 HERBICIDE COMPOSITIONS Bayer Aktiengesellschaft (DE) 2021-10-13 EP disclosed
EP-3890488-A1 HERBICIDAL COMPOSITIONS Bayer Aktiengesellschaft (DE) 2021-10-13 EP disclosed
WO-2021001273-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-01-07 WO disclosed
WO-2020114934-A1 HERBICIDE COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2020-06-11 WO disclosed
WO-2020114932-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2020-06-11 WO disclosed
CN-209854032-U Production system of 4- (2, 4-dichlorophenoxy) sodium phenolbutyrate 辽宁先达农业科学有限公司 2019-12-27 CN disclosed
US-20070135307-A1 Inhibition of tuber sprouting ACETO AGRICULTURAL CHEMICALS CORP. (US) 2007-06-14 US disclosed
WO-2007044200-A2 INHIBITION OF TUBER SPROUTING ACETO AGRICULTURAL CHEMICALS CORPORATION (US) 2007-04-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260138958-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES CBR1, CBR3, HDHD5 MAPT 4714/4885HPGD 1222/4885RAB9A 1658/4885
US-20070135307-A1 Inhibition of tuber sprouting PF4, PDGFA, PDGFRB MAPT 2432/4885HPGD 3261/4885RAB9A 3239/4885
US-20230000079-A1 COMBINATION COMPRISING A TRIKETONE HERBICIDE AND A DIPHENYLETHER HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION DDT, TDO2, DNTT MAPT 1128/4885HPGD 1751/4885RAB9A 4872/4885
US-12568967-B2 Compositions comprising pyridine carboxylate herbicides with synthetic auxin herbicides or auxin transport inhibitors DDT, SLC16A3, HPD MAPT 3058/4885HPGD 629/4885RAB9A 4568/4885
US-20260144252-A1 BROMINE- OR IODINE-PARA-SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND THEIR SALTS, AGENTS FOR PROTECTING USEFUL PLANTS OR CROP PLANTS COMPRISING THEM, METHODS FOR PRODUCING THEM AND THEIR USE AS SAFENERS CBR3, CBR1, CA3 MAPT 4647/4885HPGD 2882/4885RAB9A 2676/4885
US-12543737-B2 Herbicidal composition and method for controlling weeds PRDX6, PPOX, PRDX2 MAPT 2698/4885HPGD 3046/4885RAB9A 3305/4885
US-20260047579-A1 METHOD OF CONTROLLING WEEDS WIZ, CYP4X1, CYP2C18 MAPT 1367/4885HPGD 1407/4885RAB9A 2543/4885
US-20260042731-A1 (2,4-DICHLOROPHENOXY)ACETIC ACID ANALOGS DDT, AADAC, HACL2 MAPT 3959/4885HPGD 4066/4885RAB9A 812/4885
US-12604894-B2 Solid pesticidal formulation DDT, TPP1, CHI3L2 MAPT 3362/4885HPGD 4018/4885RAB9A 2836/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.