SCHEMBL4048491

SCHEMBL4048491

CC(C)(C)C(=O)Cn1nc(C(=O)N[C@H](C(N)=O)C(C)(C)C)c2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.72
CNR2 P34972 7/20 0.72
CFD P00746 5/20 0.44
KDM4E B2RXH2 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
SCHEMBL13690950 0.87 CNR1 (0.70) CNR1CNR2CFDKDM4E
SCHEMBL4050207 0.87 CNR1 (0.70) CNR1CNR2CFDKDM4E
SCHEMBL13691111 0.87 CNR1 (0.70) CNR1CNR2CFDKDM4E
SCHEMBL30445619 0.85 CNR1 (0.72) CNR1CNR2
SCHEMBL12884888 0.85 CNR1 (0.72) CNR1CNR2
SCHEMBL29275142 0.84 CNR1 (1.00) CNR1CNR2KDM4E
SCHEMBL30609587 0.84 CNR1 (1.00) CNR1CNR2KDM4E
SCHEMBL13690564 0.84 CNR1 (0.65) CNR1CNR2CFDKDM4E
SCHEMBL13691008 0.83 CNR1 (0.64) CNR1CNR2CFDKDM4E
SCHEMBL24222015 0.83 CNR1 (0.76) CNR1CNR2KDM4E

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-2009106980-A2 INDAZOLE DERIVATIVES PFIZER INC. (US) 2009-09-03 WO claimed