SCHEMBL6253613

SCHEMBL6253613

CCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCOS(=O)(=O)[O-].CCCCCCCCCCCCc1ccccc1.[Na+].[Na+]

nearest known ligand 0.65

Known targets — ChEMBL curated mechanism

S1PR1S1PR2S1PR3S1PR4S1PR5rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
▸ RECQL P46063 2/20 0.65
▸ GLA P06280 1/20 0.65
▸ HPGD P15428 1/20 0.65
▸ TSHR P16473 1/20 0.65
▸ MAPK1 P28482 1/20 0.65
▸ EPHX2 P34913 1/20 0.65
▸ BLM P54132 1/20 0.65
▸ FUT7 Q11130 1/20 0.51
▸ KCNH2 Q12809 1/20 0.48
▸ CA2 P00918 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ CETP P11597 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ CNR2 P34972 1/20 0.42

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
Sulfuric Acid SCHEMBL10845194 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL11618606 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL544764 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL17003825 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL10969631 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL64908 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL2347222 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL17003947 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Sulfuric Acid SCHEMBL15752866 0.86 KCNH2 (0.57) HPGDFUT7KCNH2CA2MEN1
Benzene SCHEMBL15752865 0.86 RECQL (0.88) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005047354-A1 PROCESS FOR PRODUCING HOMO-AND CO-POLYMERS BY RAFT EMULSION POLYMERIZATION ETH Zürich (CH) 2005-05-26 — — WO disclosed
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