SCHEMBL28637010

SCHEMBL28637010

C=CC(=O)OC(C)CCCCC(CCCOP(=O)(O)O)[N+](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.36
LPAR2 Q9HBW0 6/20 0.36
LPAR1 Q92633 4/20 0.33

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
SCHEMBL28652607 0.97 LPAR3 (0.36) LPAR3LPAR2LPAR1
SCHEMBL28632853 0.95 LPAR2 (0.33) LPAR3LPAR2
SCHEMBL28925243 0.93 LPAR2 (0.33) LPAR3LPAR2
SCHEMBL5174987 0.89 LPAR3 (0.44) LPAR3LPAR2LPAR1
SCHEMBL28639879 0.89 TSHR (0.33) LPAR3
Ammonia Solution, Strong SCHEMBL28190671 0.88 LPAR3 (0.42) LPAR3LPAR2LPAR1
SCHEMBL28189957 0.88 LPAR3 (0.42) LPAR3LPAR2LPAR1
SCHEMBL5173930 0.88 LPAR3 (0.46) LPAR3LPAR2LPAR1
SCHEMBL28221577 0.87 LPAR3 (0.49) LPAR3LPAR2LPAR1
SCHEMBL28504236 0.86 TSHR (0.33) LPAR3

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
CN-108463493-B Polymeric substrate having a surface with reduced biomolecule adhesion and thermoplastic articles of such substrate SIO2医药产品公司 2021-10-15 CN disclosed