SCHEMBL2817416

SCHEMBL2817416

O=S(=O)([O-])c1ccc2[nH]c(S)nc2c1.[Na+]

nearest known ligand 0.43

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 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TAS2R14 Q9NYV8 1/20 0.35
FLT3 P36888 1/20 0.34
PTPN1 P18031 2/20 0.33
TERT O14746 1/20 0.32
NPBWR1 P48145 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
PARP1 P09874 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
NOD1 Q9Y239 1/20 0.30

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
Water SCHEMBL18890705 0.98 LMNA (0.37) LMNATDP1TAS2R14FLT3PTPN1
SCHEMBL2817421 0.87 NPBWR1 (0.42) LMNATDP1NPBWR1HDAC6
Water SCHEMBL18890706 0.85 NPBWR1 (0.41) LMNATDP1NPBWR1HDAC6
SCHEMBL3391197 0.83 MAPT (0.44) LMNATDP1
SCHEMBL1160168 0.83 HDAC6 (0.46) LMNATDP1TAS2R14HDAC6L3MBTL1
Water SCHEMBL28362650 0.82 HDAC6 (0.44) TDP1TAS2R14HDAC6L3MBTL1PARP1
SCHEMBL2817420 0.82 HDAC6 (0.44) LMNATDP1TAS2R14HDAC6L3MBTL1
Water SCHEMBL28362573 0.81 HDAC6 (0.43) TDP1TAS2R14HDAC6L3MBTL1PARP1
Ensulizole SCHEMBL3173641 0.75 NPBWR1 (0.58) LMNANPBWR1HDAC6
SCHEMBL16134559 0.73 LMNA (0.47) LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118272876-A Method for manufacturing electrolytic copper foil with high tensile strength after heat treatment 陕西未来尖端材料科技有限公司 2024-07-02 CN claimed
CN-118241268-A High tensile strength electrolytic copper foil additive, electrolytic copper foil and preparation method 陕西未来尖端材料科技有限公司 2024-06-25 CN claimed
EP-4385496-A2 COMPOSITIONS FOR REMOVING NECROTIC OR INFECTED TISSUES FROM BODY SURFACE LESIONS AND FROM ORAL CAVITY DEBx Medical Holding BV (NL) 2024-06-19 EP claimed
EP-3923923-B1 COMPOSITIONS FOR REMOVING NECROTIC OR INFECTED TISSUES FROM BODY SURFACE LESIONS AND FROM ORAL CAVITY DEBx Medical Holding BV (NL) 2024-06-05 EP claimed
WO-2023219269-A1 METHOD FOR CONTROLLING PROPERTIES OF ELECTROLYTIC COPPER FOIL, AND MANUFACTURING METHOD THEREFOR 고려아연 주식회사 2023-11-16 WO claimed
CN-115012007-B Copper-graphene electroplating solution, copper-graphene composite foil and preparation method thereof 江西理工大学 2023-09-26 CN claimed
CN-113373482-B Pulse copper electroplating additive, electroplating solution and application of electroplating solution 深圳市贝加电子材料有限公司 2023-06-20 CN claimed
CN-113369489-B Luminescent silver nanocluster and preparation method and application thereof 山西大学 2023-03-07 CN claimed
US-20220401392-A1 Compositions for removing necrotic or infected tissues from body surface lesions and from oral cavity DEBx Medical Holding B.V. (NL) 2022-12-22 US claimed
CN-115012007-A Copper-graphene electroplating solution, copper-graphene composite foil and preparation method thereof 江西理工大学 2022-09-06 CN claimed
EP-1276557-A2 SIMULATED ACTIVITY OF PROTEIN A DISPLAYED BY LIGANDS ATTACHED TO A CELLULOSE BEAD SURFACE Accurate Polymers, Ltd. (US) 2003-01-22 EP claimed
US-20020156333-A1 Instant degradation of plastics into soluble non-toxic products ROSEN OREN (IL) 2002-10-24 US claimed
WO-2002062924-A1 INSTANT DEGRADATION OF PLASTICS TO SOLUBLE NON-TOXIC PRODUCTS ROSEN OREN (IL) 2002-08-15 WO claimed
EP-0944564-B1 HALOGEN EXCHANGE REACTIONS AND USES THEREOF ALBEMARLE CORP (US) 2002-03-20 EP claimed
US-20010045384-A1 Simulated activity of protein a displayed by ligands attached to a cellulose bead surface ACCURATE POLYMERS, LTD. 2001-11-29 US claimed
WO-2001083515-A2 SIMULATED ACTIVITY OF PROTEIN A DISPLAYED BY LIGANDS ATTACHED TO A CELLULOSE BEAD SURFACE ACCURATE POLYMERS, INC. (US) 2001-11-08 WO claimed
US-5187050-A Adding single replenisher containaing 3-pyrazolidone developer FUJI PHOTO FILM CO., LTD. (JP) 1993-02-16 US claimed
EP-0164120-B1 A METHOD FOR HIGH CONTRAST DEVELOPMENT OF A SILVER HALIDE PHOTOGRAPHIC MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1989-11-15 EP claimed
US-4668605-A SILVER HALIDE MATERIAL CONTAINING A HYDRAZINE DERIVATIVE FUJI PHOTO FILM CO., LTD. (JP) 1987-05-26 US claimed
EP-0164120-A2 A method for high contrast development of a silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1985-12-11 EP claimed

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-20220401392-A1 Compositions for removing necrotic or infected tissues from body surface lesions and from oral cavity TAS2R5, TAS2R40, TST LMNA 4564/4885TDP1 3642/4885TAS2R14 30/4885
US-20020156333-A1 Instant degradation of plastics into soluble non-toxic products REL, STRA6, RARA LMNA 1258/4885TDP1 4235/4885TAS2R14 3834/4885

“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.