SCHEMBL7889487

SCHEMBL7889487

CCCCOP(=O)(OCCCC)N(CCO)CCO

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
LPAR3 Q9UBY5 8/20 0.42
LPAR2 Q9HBW0 6/20 0.42
LPAR1 Q92633 3/20 0.42
TSHR P16473 2/20 0.39
GAA P10253 1/20 0.36

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
SCHEMBL7900868 0.93 LPAR3 (0.53) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL9666454 0.85 CYP3A4 (0.39) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL11150874 0.84 CYP3A4 (0.52) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL9667368 0.81 LPAR3 (0.44) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL9668521 0.81 LPAR3 (0.44) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL8849731 0.81 LPAR3 (0.44) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL11156566 0.81 LPAR3 (0.52) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL8810217 0.79 CYP3A4 (0.56) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL7900885 0.78 LPAR3 (0.53) CYP3A4LPAR3LPAR2LPAR1TSHR
Trolamine SCHEMBL28296634 0.77 CYP3A4 (0.65) CYP3A4LPAR3LPAR2LPAR1TSHR

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-6190574-B1 OIL ADDITIVE KAO CORPORATION (JP) 2001-02-20 US disclosed