SCHEMBL7651599

SCHEMBL7651599

CCCCCCCCCCOP(=O)(OCCCC)OP(=O)(O)O

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 13/20 0.68
LPAR2 Q9HBW0 9/20 0.68
LPAR1 Q92633 7/20 0.68
CYP3A4 P08684 2/20 0.59
LPAR5 Q9H1C0 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL27817486 1.00 LPAR3 (0.68) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL5818846 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL28242467 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL3814364 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL6284049 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL28516396 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL28108785 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL27670630 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL28216562 0.98 LPAR3 (0.70) LPAR3LPAR2LPAR1CYP3A4LPAR5
SCHEMBL28852985 0.96 LPAR3 (0.68) LPAR3LPAR2LPAR1CYP3A4LPAR5

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-6337403-B1 CRYSTALLINE FORM OF A PHARMACEUTICAL COMPOSITION CONTAINING SAID DERIVATIVES WITH TREATING AND PREVENTING FUNGAL INFECTIONS USING BUTADIENE FLUORO BENZONITRILE GROUPS SANKYO COMPANY, LIMITED (JP) 2002-01-08 US disclosed