SCHEMBL4896522

SCHEMBL4896522

C=CCOC(CCOP)OP(=O)(O)O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.34
LPAR2 Q9HBW0 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31

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
SCHEMBL28192080 0.85 LPAR3 (0.42) SMPD1LPAR2LPAR3
SCHEMBL1012535 0.76 SMPD1 (0.42) SMPD1LPAR2LPAR3
SCHEMBL1012660 0.68 SMPD1 (0.32) SMPD1LPAR2LPAR3
SCHEMBL958655 0.66 CA1 (0.37)
SCHEMBL18048851 0.65 SMPD1 (0.30) SMPD1LPAR2LPAR3
SCHEMBL2519350 0.65 SMPD1 (0.30) SMPD1LPAR2LPAR3
SCHEMBL4551628 0.65 LPAR3 (0.44) LPAR2LPAR3
SCHEMBL7938725 0.63 MEN1 (0.39)
SCHEMBL9003015 0.60 TSHR (0.32)
SCHEMBL28412357 0.60 CA1 (0.38)

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-20080197020-A1 Method for Producing Painted, Flat Metallic Moulded Bodies BASF AKTIENGESELLSCHAFT (DE) 2008-08-21 US disclosed