SCHEMBL14669245

SCHEMBL14669245

CCCCCCCC/C=C\CCCCCCCC(=O)OCCCOP(=O)(O)OCC[N+](C)(C)C

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RY10 O00398 8/20 0.68
▸ GPR34 Q9UPC5 3/20 0.68
▸ FABP3 P05413 1/20 0.62
▸ LPAR1 Q92633 5/20 0.53
▸ ENPP2 Q13822 3/20 0.53
▸ LPAR4 Q99677 2/20 0.53
▸ LPAR5 Q9H1C0 2/20 0.53
▸ LPAR2 Q9HBW0 2/20 0.53
▸ LPAR3 Q9UBY5 2/20 0.53
▸ CES2 O00748 1/20 0.53
▸ LPAR6 P43657 1/20 0.53
▸ TRPV1 Q8NER1 1/20 0.53

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
SCHEMBL23188432 1.00 P2RY10 (0.68) P2RY10GPR34FABP3LPAR1ENPP2
SCHEMBL14758262 0.93 FABP3 (0.70) P2RY10GPR34FABP3
SCHEMBL14669246 0.90 P2RY10 (0.73) P2RY10GPR34LPAR1ENPP2LPAR4
SCHEMBL14448112 0.90 FABP3 (0.70) P2RY10GPR34FABP3
SCHEMBL29935531 0.89 SMN1; SMN2 (0.63) P2RY10GPR34
SCHEMBL21778318 0.89 P2RY10 (0.72) P2RY10GPR34LPAR1ENPP2LPAR4
SCHEMBL23188400 0.89 P2RY10 (0.72) P2RY10GPR34LPAR1ENPP2LPAR4
SCHEMBL14047308 0.88 P2RY10 (0.54) P2RY10GPR34FABP3LPAR1LPAR2
SCHEMBL9027639 0.88 FABP3 (0.56) P2RY10GPR34FABP3LPAR1ENPP2
SCHEMBL23001085 0.88 FABP3 (0.56) P2RY10GPR34FABP3LPAR1ENPP2

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-20130026051-A1 BIOSENSOR UNIVERSITY OF LEEDS (GB) 2013-01-31 — — US disclosed
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