SCHEMBL7560708

SCHEMBL7560708

Nc1ccccc1/C=C/c1cccc(N)c1S(=O)(=O)[O-].[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 20)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 2/20 0.33
CA2 known ✓ P00918 2/20 0.33
CA12 known ✓ O43570 1/20 0.33
CA4 known ✓ P22748 1/20 0.33
ADORA2A known ✓ P29274 1/20 0.31
P2RY12 known ✓ Q9H244 1/20 0.30
TTR P02766 1/20 0.36
GAA P10253 1/20 0.34
RAD51 Q06609 3/20 0.33
CA9 Q16790 3/20 0.33
CA7 P43166 2/20 0.33
CYP2C9 P11712 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
PTPN1 P18031 1/20 0.32
NFE2L2 Q16236 1/20 0.32
PTPRC P08575 1/20 0.31
HTR6 P50406 1/20 0.31

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
SCHEMBL29512263 0.89 RAD51 (0.40) TTRGAARAD51CA9CA1
SCHEMBL757243 0.81 TTR (0.41) TTRGAACA9CA1CA2
SCHEMBL28404290 0.79 TTR (0.42) TTRGAACA9CA1CA2
SCHEMBL38675 0.74 TTR (0.44) TTRGAACA9CA1CA2
SCHEMBL7549672 0.74 TTR (0.44) TTRGAACA9CA1CA2
SCHEMBL38340 0.74 CYP3A4 (0.53) GAANFE2L2CYP3A4ALOX15CASP1
SCHEMBL65321 0.74 CYP3A4 (0.53) GAANFE2L2CYP3A4ALOX15CASP1
SCHEMBL3765477 0.74 CYP3A4 (0.53) GAANFE2L2CYP3A4ALOX15CASP1
SCHEMBL11656743 0.73 TTR (0.43) TTRGAACA9CA1CA2
SCHEMBL11287552 0.72 CYP3A4 (0.50) GAANFE2L2CYP3A4ALOX15CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0626374-B1 A diaminostilbene series compound and a method for forming an image using the same FUJI PHOTO FILM CO LTD (JP) 2002-08-07 EP disclosed
EP-0631185-B1 Method for continuously processing silver halide color photosensitive material FUJI PHOTO FILM CO LTD (JP) 1997-01-02 EP disclosed
US-5395742-A IMAGEWISE EXPOSURE OF A PHOTOGRAPHIC MATERIAL TO LIGHT FUJI PHOTO FILM CO., LTD. (JP) 1995-03-07 US disclosed
US-5391467-A Covering surface of color developer replenisher with layer of floating liquid; inhibiting precipitation FUJI PHOTO FILM CO., LTD. (JP) 1995-02-21 US disclosed
EP-0631185-A1 Method for continuously processing silver halide color photosensitive material Fuji Photo Film Co., Ltd. (JP) 1994-12-28 EP disclosed
EP-0626374-A2 A diaminostilbene series compound and a method for forming an image using the same FUJI PHOTO FILM CO., LTD. (JP) 1994-11-30 EP disclosed