SCHEMBL28816477

SCHEMBL28816477

C=COP(=O)(O)OCCCCC

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 14/20 0.55
LPAR2 Q9HBW0 11/20 0.55
LPAR1 Q92633 6/20 0.55
CYP3A4 P08684 1/20 0.42
P2RY10 O00398 1/20 0.40
LPAR5 Q9H1C0 1/20 0.39

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
SCHEMBL27387649 0.98 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4P2RY10
SCHEMBL28985855 0.98 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4P2RY10
SCHEMBL28985830 0.98 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4P2RY10
SCHEMBL28985822 0.98 LPAR3 (0.58) LPAR3LPAR2LPAR1CYP3A4P2RY10
SCHEMBL8086274 0.94 CYP3A4 (0.48) LPAR3LPAR2LPAR1CYP3A4
SCHEMBL15209297 0.86 LPAR3 (0.36) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL27509685 0.85 LPAR3 (0.51) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL28052405 0.83 LPAR3 (0.57) LPAR3LPAR2LPAR1CYP3A4P2RY10
SCHEMBL497151 0.82 LPAR3 (0.71) LPAR3LPAR2LPAR1CYP3A4P2RY10
SCHEMBL17923958 0.81 CYP3A4 (0.56) LPAR3LPAR2LPAR1CYP3A4

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
CN-104277072-A Method for preparing (E)-2-aryl vinyl phosphonate derivatives CHINASUN SPECIALTY PRODUCTS CO LTD 2015-01-14 CN claimed
CN-104277072-A Method for preparing (E)-2-aryl vinyl phosphonate derivatives CHINASUN SPECIALTY PRODUCTS CO LTD 2015-01-14 CN disclosed