SCHEMBL3679781

SCHEMBL3679781

CCCCC(P)(CCCC)CCCC.CCCCCCCCOP(=O)(O)O

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 13/20 0.72
LPAR2 Q9HBW0 9/20 0.72
LPAR1 Q92633 6/20 0.72
LPAR5 Q9H1C0 1/20 0.47
SMPD1 P17405 3/20 0.46
GGPS1 O95749 1/20 0.43
FDPS P14324 2/20 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
Phosphoric Acid Monododecyl Ester SCHEMBL28883739 0.87 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5SMPD1
Hexadecyl Dihydrogen Phosphate SCHEMBL27692367 0.87 LPAR3 (0.95) LPAR3LPAR2LPAR1LPAR5SMPD1
SCHEMBL27755717 0.85 LPAR3 (0.91) LPAR3LPAR2LPAR1LPAR5SMPD1
SCHEMBL29136 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1
Phosphoric Acid Monododecyl Ester SCHEMBL11052336 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1
Phosphoric Acid Monododecyl Ester SCHEMBL9316956 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1
SCHEMBL8033780 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1
SCHEMBL22325599 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1
SCHEMBL118839 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1
SCHEMBL1923668 0.85 LPAR3 (1.00) LPAR3LPAR2LPAR1LPAR5SMPD1

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
US-20100305263-A1 CROSS-LINKABLE MASSES COMPRISING PHOSPHORUS COMPOUNDS WACKER CHEMIE AG (DE) 2010-12-02 US disclosed