SCHEMBL8933348

SCHEMBL8933348

CCCCCCCCCCCCCCCCOCC(CCP(=O)(O)O)OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.59
LPAR3 Q9UBY5 7/20 0.59
LPAR5 Q9H1C0 4/20 0.59
LPAR6 P43657 3/20 0.59
LPAR4 Q99677 3/20 0.59
LPAR2 Q9HBW0 3/20 0.59
PLCG2 P16885 2/20 0.58
PRKD3 O94806 2/20 0.49
PRKCG P05129 2/20 0.49
PRKCB P05771 2/20 0.49
PRKCA P17252 2/20 0.49
PRKCH P24723 2/20 0.49
PRKCI P41743 2/20 0.49
PRKCE Q02156 2/20 0.49
PRKCQ Q04759 2/20 0.49
PRKCZ Q05513 2/20 0.49
PRKCD Q05655 2/20 0.49
PRKD1 Q15139 2/20 0.49
AKT1 P31749 2/20 0.49
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL2059626 1.00 LPAR1 (0.59) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL11005207 0.88 LPAR3 (0.66) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL8977085 0.84 LPAR1 (0.62) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL5399602 0.83 S1PR2 (0.59) LPAR3LPAR2S1PR2S1PR1S1PR3
SCHEMBL6622436 0.83 S1PR2 (0.59) LPAR3LPAR2S1PR2S1PR1S1PR3
SCHEMBL1086079 0.83 LPAR5 (0.65) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL1086081 0.83 LPAR5 (0.65) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL3217259 0.81 LPAR3 (0.79) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL5610918 0.81 LPAR3 (0.79) LPAR1LPAR3LPAR5LPAR6LPAR4
SCHEMBL7172379 0.81 LPAR3 (0.79) LPAR1LPAR3LPAR5LPAR6LPAR4

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
WO-1996024598-A1 [4-HEXADECYL-3-METHOXY-BUTYL] PHOSPHONIC ACID AND ITS PROTEIN CONJUGATES USEFUL AS ANTI-CANCER AGENTS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 1996-08-15 WO disclosed