SCHEMBL8637860

SCHEMBL8637860

O=S(=O)([O-])c1cc(Nc2cc(Oc3ccc4ccccc4c3)nc(Cl)n2)ccc1-c1ccc(Nc2cc(Oc3ccc4ccccc4c3)nc(Cl)n2)cc1S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.39

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
▸ PPARG known ✓ P37231 2/20 0.39
▸ P2RY12 known ✓ Q9H244 5/20 0.38
▸ P2RY2 known ✓ P41231 7/20 0.37
▸ P2RY1 known ✓ P47900 2/20 0.37
▸ P2RY4 known ✓ P51582 5/20 0.37
▸ P2RY6 known ✓ Q15077 2/20 0.37
▸ THRB known ✓ P10828 1/20 0.36
▸ FUT8 Q9BYC5 2/20 0.37
▸ ENTPD1 P49961 2/20 0.37
▸ PGR P06401 1/20 0.37
▸ P2RX2 Q9UBL9 1/20 0.36
▸ PLA2G7 Q13093 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36

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
SCHEMBL9454000 0.89 PPARG (0.39) PPARGPGRPLA2G7USP2LMNA
SCHEMBL8637841 0.88 PPARG (0.39) PPARGPGRPLA2G7USP2LMNA
SCHEMBL8637879 0.88 PPARG (0.39) PPARGPGRPLA2G7USP2APEX1
SCHEMBL8014411 0.84 PPARG (0.39) PPARGP2RY12P2RY2P2RY1FUT8
SCHEMBL8003076 0.79 RAD51 (0.47) PPARGP2RY2ENTPD1PGRPLA2G7
SCHEMBL8943258 0.75 RAD51 (0.44) MEN1USP2CYP3A4MAPTHPGD
SCHEMBL9587946 0.74 PPARG (0.32) PPARGPGRPLA2G7
SCHEMBL9069786 0.73 KDR (0.41) PPARGPLA2G7USP2MAPTAPEX1
SCHEMBL9551807 0.72 KDR (0.41) PPARGPGRPLA2G7USP2MAPT
SCHEMBL8014438 0.72 KDR (0.41) PPARGPLA2G7USP2MAPTAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481333-B1 A silver halide color photographic material FUJI PHOTO FILM CO LTD (JP) 1998-08-12 — — EP disclosed
EP-0421452-B1 Silver halide photographic material FUJI PHOTO FILM CO LTD (JP) 1996-06-19 — — EP disclosed
US-5288604-A Containing sensitizing cyanine dye; high infrared sensitivity FUJI PHOTO FILM CO., LTD. (JP) 1994-02-22 — — US disclosed
EP-0313022-B1 SILVER HALIDE PHOTOSENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1993-03-31 — — EP disclosed
US-5187053-A Storage stability FUJI PHOTO FILM CO., LTD. (JP) 1993-02-16 — — US disclosed
US-5176993-A Layer containing a nitrogen-heterocyclic compound, high silver chloride and a red-sensitive sensitizer dye; high speed development; high photosensitivity; storage stability FUJI PHOTO FILM CO., LTD. (JP) 1993-01-05 — — US disclosed
US-5137803-A Sensitizing desalted silver chlorobromide grains in the presence of a nucleic acid or degradation product FUJI PHOTO FILM CO., LTD. (JP) 1992-08-11 — — US disclosed
EP-0481333-A1 A silver halide color photographic material Fuji Photo Film Co., Ltd. (JP) 1992-04-22 — — EP disclosed
EP-0313021-B1 SILVER HALIDE PHOTOGRAPHIC MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1991-04-10 — — EP disclosed
US-4939080-A Silver halide photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 1990-07-03 — — US disclosed
EP-0368356-A1 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1990-05-16 — — EP disclosed
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