SCHEMBL9704769

SCHEMBL9704769

CCCCCCCCCCC(O)COCCC

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.62
HTT P42858 1/20 0.60
HSD17B10 Q99714 1/20 0.52
LPAR5 Q9H1C0 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
GPR84 Q9NQS5 7/20 0.48
FFAR4 Q5NUL3 1/20 0.47
FFAR1 O14842 1/20 0.47
SPHK1 Q9NYA1 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
PLA2G2C Q5R387 2/20 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
SCHEMBL5831106 1.00 USP2 (0.62) USP2HTTHSD17B10LPAR5CYP1A2
SCHEMBL8445968 0.96 USP2 (0.62) USP2HTTHSD17B10LPAR5CYP1A2
SCHEMBL4295700 0.94 USP2 (0.71) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL10420535 0.94 USP2 (0.66) USP2HTTHSD17B10LPAR5CYP1A2
SCHEMBL9330015 0.94 USP2 (0.71) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL7644994 0.94 USP2 (0.71) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL7196477 0.94 USP2 (0.66) USP2HTTHSD17B10LPAR5CYP1A2
SCHEMBL17194443 0.94 USP2 (0.60) USP2HTTHSD17B10LPAR5CYP1A2
SCHEMBL10893424 0.94 USP2 (0.71) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL3392479 0.94 USP2 (0.71) USP2HTTLPAR5CYP1A2CYP3A4

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-1992013511-A1 STABLE THREE-PHASE SYSTEMS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1992-08-20 WO disclosed