SCHEMBL28355690

SCHEMBL28355690

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)CCOP(=O)(O)O

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 9/20 0.66
LPAR1 Q92633 7/20 0.66
LPAR2 Q9HBW0 6/20 0.66
LPAR5 Q9H1C0 1/20 0.46
S1PR2 O95136 1/20 0.44
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
S1PR5 Q9H228 1/20 0.44
ENPP2 Q13822 1/20 0.42
GGPS1 O95749 3/20 0.42

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
SCHEMBL26624051 1.00 LPAR3 (0.66) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9075862 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9078716 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9078529 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9079360 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9079363 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9078239 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9078543 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9079001 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2
SCHEMBL9077143 0.93 LPAR3 (0.78) LPAR3LPAR1LPAR2LPAR5S1PR2

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-110791964-B Treating agent for elastic fiber and elastic fiber 竹本油脂株式会社 2020-10-23 CN disclosed
CN-110791964-A Treating agent for elastic fiber and elastic fiber 竹本油脂株式会社 2020-02-14 CN disclosed