SCHEMBL23095082

SCHEMBL23095082

CCCCOCC(O)COCCCCC(C)(C)OCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.50
HTT P42858 1/20 0.49
LPAR5 Q9H1C0 4/20 0.46
SPHK1 Q9NYA1 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
CASR P41180 2/20 0.39
HSD17B10 Q99714 1/20 0.37
PLA2G2C Q5R387 1/20 0.37
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.34
P2RY10 O00398 1/20 0.34
LPAR1 Q92633 5/20 0.33
LPAR3 Q9UBY5 5/20 0.33
LPAR2 Q9HBW0 4/20 0.33
LPAR6 P43657 3/20 0.33
LPAR4 Q99677 3/20 0.33

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
SCHEMBL27097789 0.88 USP2 (0.45) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL19865138 0.82 USP2 (0.41) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL23095053 0.82 USP2 (0.50) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL23095067 0.81 USP2 (0.51) USP2HTTLPAR5CYP1A2CYP3A4
Dibuprol SCHEMBL1816462 0.80 USP2 (0.65) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL16001419 0.79 USP2 (0.52) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL13492154 0.79 USP2 (0.52) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL16001432 0.79 USP2 (0.52) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL24612929 0.79 USP2 (0.38) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL19865130 0.79 USP2 (0.38) USP2HTTLPAR5

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-10947476-B2 Polyfluoro lubricant compositions SEAGATE TECHNOLOGY LLC (US) 2021-03-16 US disclosed