SCHEMBL4459952

SCHEMBL4459952

CCCCCCCCc1ccc(OCCOCCS(=O)(=O)[O-])cc1.[Na+]

nearest known ligand 0.64

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
CA2 known ✓ P00918 2/20 0.44
CA12 known ✓ O43570 1/20 0.44
CA1 known ✓ P00915 1/20 0.44
MEN1 O00255 1/20 0.64
USP2 O75604 1/20 0.64
ALDH1A1 P00352 1/20 0.64
LMNA P02545 1/20 0.64
CYP3A4 P08684 1/20 0.64
MAPK1 P28482 1/20 0.64
CASP1 P29466 1/20 0.64
KMT2A Q03164 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
SLCO1B3 Q9NPD5 1/20 0.64
SLCO1B1 Q9Y6L6 1/20 0.64
S1PR1 P21453 1/20 0.47
FUT7 Q11130 1/20 0.46
TSHR P16473 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
PLA2G4A P47712 2/20 0.44

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
SCHEMBL27518731 1.00 MEN1 (0.64) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL11511436 0.93 MEN1 (0.61) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL28437698 0.89 MEN1 (0.55) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL9393646 0.88 MEN1 (0.53) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL2235313 0.87 MAPK1 (0.64) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL340519 0.87 MAPK1 (0.64) MEN1USP2ALDH1A1LMNACYP3A4
Potassium Ion SCHEMBL29760204 0.87 MEN1 (0.55) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL5490689 0.86 MEN1 (0.69) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL4955027 0.86 MEN1 (0.69) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL11254222 0.85 ALDH1A1 (0.85) MEN1USP2ALDH1A1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531298-B2 Silver halide color photosensitive material FUJIFILM CORPORATION (JP) 2009-05-12 US disclosed
US-7195864-B2 Silver halide photographic light-sensitive material and aqueous coating composition FUJI PHOTO FILM CO., LTD. (JP) 2007-03-27 US disclosed
EP-1750173-A1 Silver halide photosensitive material and packaged body containing the same Fuji Photo Film Co., Ltd. (JP) 2007-02-07 EP disclosed
US-7122299-B2 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 2006-10-17 US disclosed
US-20050142505-A1 Silver halide photographic light-sensitive material and aqueous coating composition FUJI PHOTO FILM CO., LTD. 2005-06-30 US disclosed
US-20050106513-A1 Blue, green, red-sensitive layer and a non-light-sensitive layer on a support and a silver halide color photosensitive material of a fluorinated diester metal salt; capable of undergoing a one-electron oxidation to a one-electron oxidation product capable of releasing electrons and forming a bond FUJI PHOTO FILM CO., LTD. 2005-05-19 US disclosed
US-20050032008-A1 Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. 2005-02-10 US disclosed
US-6844146-B2 Silver halide color photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2005-01-18 US disclosed
US-20040185392-A1 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. 2004-09-23 US disclosed
US-20030235793-A1 SILVER HALIDE PHOTOGRAPHIC PHOTOSENSITIVE MATERIAL FUJIFILM CORPORATION (JP) 2003-12-25 US disclosed
US-5206134-A Adding simultaneously silver nitrate and metal iodide solutions or adding fine particles of silver iodide and/or silver iodobromide, producing grains with low surface iodide content FUJI PHOTO FILM CO., LTD. (JP) 1993-04-27 US disclosed
EP-0528435-A1 Silver halide photographic material FUJI PHOTO FILM CO., LTD. (JP) 1993-02-24 EP disclosed
US-5118600-A Having improved developability, sensitivity/fogging ratio and pressure characteristics FUJI PHOTO FILM CO., LTD. (JP) 1992-06-02 US disclosed
US-5108885-A Antistatic agents FUJI PHOTO FILM CO., LTD. (JP) 1992-04-28 US disclosed
EP-0475191-A2 Method for producing silver halide photographic emulsion FUJI PHOTO FILM CO., LTD. (JP) 1992-03-18 EP disclosed
EP-0438135-A1 Silver halide photographic photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 1991-07-24 EP disclosed
US-5028520-A Polyhydroxybenzene Compound, Reduction of Reflection Index, Crossover Elimination FUJI PHOTO FILM CO., LTD. (JP) 1991-07-02 US disclosed
US-5015562-A Light-sensitive silver halide element containing modant, dye and sonic polymer FUJI PHOTO FILM CO., LTD. (JP) 1991-05-14 US disclosed
EP-0423693-A2 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-04-24 EP disclosed
US-4895791-A ANIONIC POLYMER AND HYDROXY-CONTAINING COMPOUND; STRESS RESISTANCE; WITHSTANDS PRESSURE AND BENDING; MECHANICAL PROPERTIES FUJI PHOTO FILM CO., LTD. (JP) 1990-01-23 US disclosed