SCHEMBL4533955

SCHEMBL4533955

O=P(O)(O)OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=S)S

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 14/20 0.53
LPAR2 Q9HBW0 11/20 0.53
LPAR1 Q92633 7/20 0.53
ENPP2 Q13822 1/20 0.35
LPAR5 Q9H1C0 1/20 0.34

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
SCHEMBL4533580 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4525685 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4529007 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4538823 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4530286 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4527062 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4517304 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4524025 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4528601 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5
SCHEMBL4533180 1.00 LPAR3 (0.53) LPAR3LPAR2LPAR1ENPP2LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090123516-A1 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS-THERAPEUTIC SAMS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-05-14 US disclosed
WO-2007019478-A2 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS - THERAPEUTIC SAMS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-02-15 WO disclosed