SCHEMBL6651576

SCHEMBL6651576

CCCCC(O)COS(=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 20)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 4/20 0.38
CA1 known ✓ P00915 1/20 0.38
CA4 known ✓ P22748 1/20 0.38
RECQL P46063 2/20 0.48
GLA P06280 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
EPHX2 P34913 1/20 0.48
BLM P54132 1/20 0.48
NFKB1 P19838 1/20 0.41
GPR84 Q9NQS5 5/20 0.40
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
FFAR4 Q5NUL3 1/20 0.34
FFAR1 O14842 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
VEGFA P15692 2/20 0.33

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
SCHEMBL27157146 0.93 RECQL (0.55) RECQLGLAHPGDTSHRMAPK1
SCHEMBL23928053 0.93 RECQL (0.55) RECQLGLAHPGDTSHRMAPK1
SCHEMBL6651738 0.81 TP53 (0.38) RECQLTSHRNFKB1GPR84CA2
SCHEMBL8924040 0.79 RECQL (0.50) RECQLGLAHPGDTSHRMAPK1
SCHEMBL258038 0.78 RECQL (0.59) RECQLGLAHPGDTSHRMAPK1
SCHEMBL258049 0.78 RECQL (0.59) RECQLGLAHPGDTSHRMAPK1
Ethasulfuric Acid SCHEMBL30312334 0.78 CYP3A4 (0.50) RECQLGLAHPGDTSHRMAPK1
Ethasulfuric Acid SCHEMBL57666 0.78 CYP3A4 (0.50) RECQLGLAHPGDTSHRMAPK1
SCHEMBL7755504 0.77 RECQL (0.68) RECQLGLAHPGDTSHRMAPK1
SCHEMBL8852116 0.77 RECQL (0.73) RECQLGLAHPGDTSHRMAPK1

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-0897808-B1 Recording sheets and ink jet printing processes therewith XEROX CORP (US) 2004-06-16 EP claimed
US-6117527-A RECORDING SHEET COMPRISING SUBSTRATE HAVING IMAGE-RECEIVING COATING ON SURFACE COMPRISING BINDER POLYMER AND SELECTED ADDITIVE; HIGH QUALITY IMAGES WITH REDUCED OR NO HAZE XEROX CORPORATION (US) 2000-09-12 US claimed
EP-0897808-A1 Recording sheets and ink jet printing processes therewith Xerox Corporation (US) 1999-02-24 EP claimed
EP-0897808-B1 Recording sheets and ink jet printing processes therewith XEROX CORP (US) 2004-06-16 EP disclosed
US-6117527-A RECORDING SHEET COMPRISING SUBSTRATE HAVING IMAGE-RECEIVING COATING ON SURFACE COMPRISING BINDER POLYMER AND SELECTED ADDITIVE; HIGH QUALITY IMAGES WITH REDUCED OR NO HAZE XEROX CORPORATION (US) 2000-09-12 US disclosed
EP-0897808-A1 Recording sheets and ink jet printing processes therewith Xerox Corporation (US) 1999-02-24 EP disclosed