SCHEMBL38569

SCHEMBL38569

O=S(=O)([O-])c1cccc(-c2cccc(C=Cc3ccccc3)c2C=Cc2ccccc2)c1S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.36

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 13)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 1/20 0.32
RAD51 Q06609 3/20 0.36
NFE2L2 Q16236 6/20 0.35
TRPA1 O75762 2/20 0.35
TRPV1 Q8NER1 1/20 0.33
PKLR P30613 1/20 0.33
NR1H2 P55055 1/20 0.32
PTPN1 P18031 1/20 0.32
LMNA P02545 1/20 0.32
SLC16A3 O15427 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL28674571 0.90 RAD51 (0.38) RAD51NFE2L2TRPA1TRPV1PKLR
SCHEMBL3936742 0.86 NFE2L2 (0.41) RAD51NFE2L2TRPA1NR1H2LMNA
SCHEMBL14484833 0.84 NFE2L2 (0.42) RAD51NFE2L2TRPA1NR1H2LMNA
SCHEMBL14484832 0.84 NFE2L2 (0.42) RAD51NFE2L2TRPA1NR1H2LMNA
SCHEMBL2524357 0.84 NFE2L2 (0.42) RAD51NFE2L2TRPA1NR1H2PTPN1
(Z)-1,2-Diphenylethene SCHEMBL28675607 0.83 PTPN1 (0.39) RAD51NFE2L2TRPV1PKLRPTPN1
SCHEMBL2528157 0.81 TRPA1 (0.40) NFE2L2TRPA1TRPV1NR1H2LMNA
SCHEMBL566321 0.80 TRPA1 (0.39) NFE2L2TRPA1TRPV1NR1H2SLC16A3
SCHEMBL27453977 0.79 RAD51 (0.48) RAD51NFE2L2TRPA1NR1H2LMNA
SCHEMBL15982 0.78 TRPV1 (0.32) TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230371513-A1 PHOTOSTABLE COMPOSITION AND METHOD OF REDUCING OR CONTROLLING WEED POPULATION APPLYING SAID COMPOSITION UPL DO BRASIL INDUSTRIA E COMERCIO DE INSUMOS AGROPECUARIOS S.A. (BR) 2023-11-23 US disclosed
CN-108368154-B Polypeptides 诺维信公司 2023-02-03 CN disclosed
CN-108350441-B Polypeptides 诺维信公司 2022-09-27 CN disclosed
CN-109072133-B Use of polypeptides having dnase activity for treating textiles 诺维信公司 2021-06-15 CN disclosed
CN-112969775-A Cleaning composition 诺维信公司 2021-06-15 CN disclosed
CN-112899086-A Detergent composition 诺维信公司 2021-06-04 CN disclosed
CN-108350400-B Laundry washing method, use of polypeptides and detergent compositions 诺维信公司 2021-03-30 CN disclosed
CN-112423728-A Detergent composition 龙沙有限责任公司 2021-02-26 CN disclosed
CN-106164236-B Detergent composition 诺维信公司 2021-02-02 CN disclosed
CN-112262207-A Polypeptides comprising carbohydrate-binding activity in detergent compositions and their use for reducing wrinkles in textiles or fabrics 诺维信公司 2021-01-22 CN disclosed
CN-106795463-B Polypeptides having DNase activity for reducing static electricity 诺维信公司 2020-09-29 CN disclosed
CN-106414698-B Detergent composition 诺维信公司 2020-02-21 CN disclosed
WO-2020036064-A1 OIL-IN-WATER EMULSION COSMETIC COMPOSITION ダウ・東レ株式会社 2020-02-20 WO disclosed
US-9125411-B2 UV absorbers for reducing the E/Z isomerization of pesticides BASF SE (DE) 2015-09-08 US disclosed
WO-2013072852-A4 STRETCH MARK PREVENTER JINDAL SONIA H (IN) 2013-07-11 WO disclosed
WO-2013072852-A1 STRETCH MARK PREVENTER JINDAL SONIA H (IN) 2013-05-23 WO disclosed
EP-2584896-A2 HERBICIDAL COMPOSITIONS BASF SE (DE) 2013-05-01 EP disclosed
US-20130102463-A1 Herbicidal Compositions BASF SE (DE) 2013-04-25 US disclosed
WO-2011161105-A2 HERBICIDAL COMPOSITIONS BASF SE (DE) 2011-12-29 WO disclosed
US-20110257265-A1 UV Absorbers for Reducing the E/Z Isomerization of Pesticides BASF SE (DE) 2011-10-20 US 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 (2 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-20130102463-A1 Herbicidal Compositions PPOX, PAOX, DDT PPARG 641/4885RAD51 3292/4885NFE2L2 1851/4885
US-20110257265-A1 UV Absorbers for Reducing the E/Z Isomerization of Pesticides DDT, PIN1, ERCC4 PPARG 1080/4885RAD51 1225/4885NFE2L2 704/4885

“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.