SCHEMBL17801385

SCHEMBL17801385

CC(=Cc1ccccc1)S(=O)(=O)[O-].[Na+]

nearest known ligand 0.48

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 15)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 2/20 0.43
CA1 known ✓ P00915 1/20 0.40
CA2 known ✓ P00918 1/20 0.40
CA4 known ✓ P22748 1/20 0.40
FBP1 P09467 3/20 0.48
AKR1C3 P42330 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
RECQL P46063 1/20 0.42
HTT P42858 1/20 0.41
CA7 P43166 1/20 0.40
AKR1C2 P52895 1/20 0.40
AKR1C1 Q04828 1/20 0.40
GLA P06280 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL28418953 0.79 FBP1 (0.49) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL2861584 0.79 AKR1C3 (0.52) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL750813 0.79 AKR1C3 (0.52) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL18492569 0.79 FBP1 (0.42) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL5419434 0.78 AKR1C3 (0.50) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL28850007 0.78 AKR1C3 (0.50) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL28849988 0.78 AKR1C3 (0.50) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL11540895 0.78 AKR1C3 (0.50) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL5418658 0.78 AKR1C3 (0.50) FBP1AKR1C3ALDH1A1TSHRPTGS2
SCHEMBL11540897 0.78 AKR1C3 (0.50) FBP1AKR1C3ALDH1A1TSHRPTGS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119800360-A Cu-Mo alloy multi-film structure etching solution composition 四川和晟达电子科技有限公司 2025-04-11 CN claimed
EP-3227385-A1 POLYMER LATEX COMPOSITION FOR FIBRE BINDING Synthomer Deutschland GmbH (DE) 2017-10-11 EP disclosed
WO-2016087255-A1 POLYMER LATEX COMPOSITION FOR FIBRE BINDING SYNTHOMER DEUTSCHLAND GMBH (DE) 2016-06-09 WO disclosed