SCHEMBL9813387

SCHEMBL9813387

CCCCCCCCCCCCOCC(O)COCC(CO)OCCCCCCCC

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.69
HTT P42858 1/20 0.57
LPAR5 Q9H1C0 1/20 0.54
LPAR1 Q92633 4/20 0.53
LPAR3 Q9UBY5 4/20 0.53
LPAR2 Q9HBW0 1/20 0.53
SPHK1 Q9NYA1 1/20 0.49
ALDH1A1 P00352 1/20 0.47
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
TLR2 O60603 2/20 0.46
PLA2G2C Q5R387 1/20 0.46
DNM1 Q05193 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL9813378 0.98 USP2 (0.67) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL2070284 0.92 USP2 (0.63) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL9813411 0.92 USP2 (0.71) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL3325348 0.92 USP2 (0.71) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL2840856 0.92 USP2 (0.71) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL2354120 0.92 USP2 (0.71) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL2345876 0.92 USP2 (0.71) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL2347220 0.92 USP2 (0.71) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL25266425 0.91 USP2 (0.63) USP2HTTLPAR5LPAR1LPAR3
SCHEMBL2417250 0.91 USP2 (0.63) USP2HTTLPAR5LPAR1LPAR3

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
EP-0162239-B1 PERCUTANEOUS ABSORPTION ACCELERATOR AND PREPARATION CONTAINING SAME Kao Corporation (JP) 1991-08-07 EP disclosed