SCHEMBL28453080

SCHEMBL28453080

CCCCOC(C)OP(=O)(O)OC(C)(OCCCC)OCCCC

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 5/20 0.33
LPAR1 Q92633 4/20 0.33
SMPD1 P17405 6/20 0.32
LPAR2 Q9HBW0 2/20 0.31
CYP3A4 P08684 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
SCHEMBL8050906 0.96 LPAR3 (0.39) LPAR3LPAR1SMPD1LPAR2
SCHEMBL2520483 0.82 LPAR3 (0.40) LPAR3LPAR1SMPD1LPAR2CYP3A4
SCHEMBL18423586 0.78 LMNA (0.38) LPAR3LPAR1SMPD1LPAR2CYP3A4
SCHEMBL10826888 0.76 LPAR3 (0.39) LPAR3LPAR1SMPD1LPAR2CYP3A4
SCHEMBL2801016 0.76 LPAR3 (0.40) LPAR3LPAR1SMPD1LPAR2CYP3A4
SCHEMBL28520719 0.76 LPAR3 (0.39) LPAR3LPAR1SMPD1LPAR2CYP3A4
SCHEMBL2523264 0.76 LPAR3 (0.50) LPAR3LPAR1SMPD1LPAR2
SCHEMBL2521045 0.76 LPAR3 (0.50) LPAR3LPAR1SMPD1LPAR2
SCHEMBL127571 0.76 SMPD1 (0.47) LPAR3LPAR1SMPD1LPAR2CYP3A4
SCHEMBL887887 0.76 SMPD1 (0.48) LPAR3LPAR1SMPD1LPAR2CYP3A4

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-111699224-A Coating composition with improved corrosion resistance PPG工业俄亥俄公司 2020-09-22 CN disclosed