SCHEMBL4967747

SCHEMBL4967747

CC(C)CCCCCCCCCCCCCOP(=O)(O)OP(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 3/20 0.47
LPAR3 Q9UBY5 6/20 0.44
LPAR2 Q9HBW0 5/20 0.44
LPAR1 Q92633 4/20 0.44
MVD P53602 2/20 0.41
GGPS1 O95749 2/20 0.38
SMPD1 P17405 2/20 0.37

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
SCHEMBL10796477 1.00 BTN3A1 (0.47) BTN3A1LPAR3LPAR2LPAR1MVD
SCHEMBL4971483 1.00 BTN3A1 (0.47) BTN3A1LPAR3LPAR2LPAR1MVD
SCHEMBL27730052 0.97 BTN3A1 (0.45) BTN3A1LPAR3LPAR2LPAR1MVD
SCHEMBL1123897 0.93 LPAR3 (0.42) BTN3A1LPAR3LPAR2LPAR1SMPD1
SCHEMBL125995 0.89 LPAR3 (0.45) LPAR3LPAR2LPAR1SMPD1
SCHEMBL230886 0.89 LPAR3 (0.45) LPAR3LPAR2LPAR1SMPD1
SCHEMBL3690198 0.89 LPAR3 (0.45) LPAR3LPAR2LPAR1SMPD1
SCHEMBL22471656 0.89 LPAR3 (0.45) LPAR3LPAR2LPAR1SMPD1
SCHEMBL28514460 0.89 LPAR3 (0.45) LPAR3LPAR2LPAR1SMPD1
SCHEMBL641417 0.89 LPAR3 (0.45) LPAR3LPAR2LPAR1SMPD1

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
EP-1933848-A2 PHOSPHOANTIGEN SALTS OF ORGANIC BASES AND METHODS FOR THEIR CRYSTALLIZATION Innate Pharma (FR) 2008-06-25 EP disclosed
WO-2007039635-A2 PHOSPHOANTIGEN SALTS OF ORGANIC BASES AND METHODS FOR THEIR CRYSTALLIZATION INNATE PHARMA (FR) 2007-04-12 WO disclosed