SCHEMBL2762340

SCHEMBL2762340

COc1ccc2c(c1)C(=O)C(=O)N2CC1CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.60
PARK7 Q99497 1/20 0.57
CHRM5 P08912 4/20 0.51
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
OPRM1 P35372 1/20 0.45
ALDH1A1 P00352 3/20 0.45
ALDH3A1 P30838 1/20 0.45
CASP3 P42574 3/20 0.44
CASP7 P55210 2/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
RCE1 Q9Y256 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL3028471 0.83 OPRM1 (0.53) POLBPARK7CHRM5OPRM1ALDH1A1
SCHEMBL6559542 0.81 PARK7 (0.64) POLBPARK7CHRM5CA12CA1
SCHEMBL4624984 0.80 PARK7 (0.63) POLBPARK7CHRM5CA12CA1
SCHEMBL17274922 0.78 PARK7 (0.69) POLBPARK7CHRM5CA12CA1
SCHEMBL29349059 0.78 ACHE (0.60) PARK7CHRM5ALDH1A1ALDH3A1CASP3
SCHEMBL13196466 0.78 CUL4A (0.43) PARK7OPRM1ALDH1A1ALDH3A1CASP3
SCHEMBL29011254 0.77 PARK7 (0.67) POLBPARK7CHRM5CA12CA1
SCHEMBL31440735 0.76 PARK7 (0.59) POLBPARK7CHRM5CA12CA1
SCHEMBL11798678 0.76 PARK7 (0.62) POLBPARK7CHRM5CA12CA1
SCHEMBL11150416 0.75 PARK7 (0.64) POLBPARK7CHRM5CA12CA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010090680-A1 SUBSTITUTED OXINDOLE CB2 AGONISTS WYETH LLC (US) 2010-08-12 WO disclosed
WO-2010090680-A1 SUBSTITUTED OXINDOLE CB2 AGONISTS WYETH LLC (US) 2010-08-12 WO disclosed