SCHEMBL10387296

SCHEMBL10387296

[O]CC(O)COCCCCOCC(O)C[O]

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.48
HTT P42858 1/20 0.47
LPAR5 Q9H1C0 1/20 0.44
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.37
SPHK1 Q9NYA1 1/20 0.34
PLA2G2C Q5R387 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
LPAR1 Q92633 2/20 0.32
LPAR3 Q9UBY5 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
P2RY10 O00398 1/20 0.31

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
SCHEMBL9851847 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL633100 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL7608392 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL6680740 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL9851883 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL23270905 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL9851874 0.87 USP2 (0.69) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL7173237 0.86 USP2 (0.57) USP2HTTLPAR5CYP1A2CYP3A4
SCHEMBL10934964 0.82
SCHEMBL7778636 0.82

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
US-4970134-A Mixture crosslinkable by photopolymerization BASF AKTIENGESELLSCHAFT (DE) 1990-11-13 US disclosed