SCHEMBL14898571

SCHEMBL14898571

CCCOP(=O)(O)OC[C@H](COC(=O)C(C)C)OC(=O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.50
LPAR3 Q9UBY5 7/20 0.43
LPAR1 Q92633 4/20 0.43
ENPP2 Q13822 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PLA2G2C Q5R387 1/20 0.39
SMPD1 P17405 1/20 0.38
LPAR2 Q9HBW0 2/20 0.37
SELP P16109 1/20 0.37
P2RY10 O00398 4/20 0.36
GPR34 Q9UPC5 2/20 0.36
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36

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
SCHEMBL12597735 0.86 FABP3 (0.60) FABP3LPAR3LPAR1SMN1; SMN2NR5A2
SCHEMBL23219294 0.82 FABP3 (0.39) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL12597761 0.81 ENPP2 (0.50) LPAR3LPAR1ENPP2SMN1; SMN2LPAR2
SCHEMBL17084575 0.81 FABP3 (0.48) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL12597739 0.80 P2RY10 (0.45) P2RY10GPR34
SCHEMBL16439845 0.79 FABP3 (0.47) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL17087043 0.79 FABP3 (0.47) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL26468965 0.79 FABP3 (0.56) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL26221781 0.79 LPAR3 (0.72) FABP3LPAR3LPAR1ENPP2SMN1; SMN2
SCHEMBL15246817 0.79 FABP3 (0.36) FABP3LPAR3LPAR1PLA2G2CLPAR2

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-8431369-B2 Method for preparation of polyunsaturated fatty acid-containing phosphatidylserine CHEN SU (US) 2013-04-30 US disclosed