SCHEMBL9851847

SCHEMBL9851847

CCCCCCCCCCCCCCCCCCOCC(O)C[O]

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.69
HTT P42858 2/20 0.67
LPAR5 Q9H1C0 4/20 0.62
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C19 P33261 1/20 0.53
SPHK1 Q9NYA1 1/20 0.51
PLA2G2C Q5R387 2/20 0.48
LPAR1 Q92633 7/20 0.47
LPAR3 Q9UBY5 7/20 0.47
CES2 O00748 1/20 0.47
MEN1 O00255 1/20 0.45
THRB P10828 1/20 0.45
KMT2A Q03164 1/20 0.45
MAPT P10636 1/20 0.45
LPAR2 Q9HBW0 4/20 0.45
LPAR6 P43657 3/20 0.45
LPAR4 Q99677 3/20 0.45

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
SCHEMBL9851874 1.00 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL6680740 1.00 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL9851883 1.00 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL7608392 1.00 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL633100 1.00 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL23270905 1.00 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL7173237 0.92 USP2 (0.57) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL10605202 0.87 USP2 (0.80) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL2853658 0.87 USP2 (0.80) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL251104 0.87 USP2 (0.80) 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
EP-0457672-A1 Toiletry preparation SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-11-21 EP disclosed