SCHEMBL11276459

SCHEMBL11276459

COCC(CCO)OC(CCO)COC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.30
LPAR6 P43657 2/20 0.30
LPAR1 Q92633 2/20 0.30
LPAR4 Q99677 2/20 0.30
LPAR5 Q9H1C0 2/20 0.30
LPAR2 Q9HBW0 2/20 0.30
LPAR3 Q9UBY5 2/20 0.30

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
SCHEMBL316627 0.83
SCHEMBL9611250 0.79 LPAR6 (0.35) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL4670276 0.79 LPAR6 (0.35) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL11270174 0.79 USP2 (0.47) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL3483316 0.78
SCHEMBL11349070 0.78 THRB (0.37)
SCHEMBL17280902 0.78 TSHR (0.32) LPAR6LPAR1LPAR4LPAR5LPAR2
SCHEMBL11273334 0.77
SCHEMBL11272278 0.77 ALDH1A1 (0.40)
SCHEMBL4920864 0.77

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
US-4330452-A Plasticizers for polyvinylchloride comprising a reaction product of alkanedicarboxic acid and alkanolether THE DOW CHEMICAL COMPANY (US) 1982-05-18 US claimed
US-4330452-A Plasticizers for polyvinylchloride comprising a reaction product of alkanedicarboxic acid and alkanolether THE DOW CHEMICAL COMPANY (US) 1982-05-18 US disclosed