SCHEMBL4056764

SCHEMBL4056764

CC(C)(C)[C@H](NC(=O)c1nn(CC2CCOCC2)c2ccc(Cl)cc12)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 9/20 0.49
CNR2 P34972 7/20 0.49
NR3C1 P04150 1/20 0.41
KDM4C Q9H3R0 1/20 0.39
ROCK1 Q13464 3/20 0.37
HTR4 Q13639 2/20 0.37
CYP3A4 P08684 1/20 0.37
ROCK2 O75116 1/20 0.36

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
SCHEMBL13690992 1.00 CNR1 (0.49) CNR1CNR2NR3C1KDM4CROCK1
SCHEMBL4052156 0.92 CNR1 (0.44) CNR1CNR2NR3C1KDM4CROCK1
SCHEMBL13691256 0.92 CNR1 (0.44) CNR1CNR2NR3C1KDM4CROCK1
SCHEMBL4055909 0.90 CNR1 (0.49) CNR1CNR2KDM4CROCK1
SCHEMBL4052192 0.90 CNR1 (0.44) CNR1CNR2NR3C1KDM4CROCK1
SCHEMBL13691001 0.90 CNR1 (0.44) CNR1CNR2NR3C1KDM4CROCK1
SCHEMBL13690926 0.89 CNR1 (0.42) CNR1CNR2NR3C1KDM4CHTR4
SCHEMBL4051939 0.89 CNR1 (0.42) CNR1CNR2NR3C1KDM4CHTR4
SCHEMBL13690995 0.88 CNR1 (0.64) CNR1CNR2NR3C1KDM4CROCK1
SCHEMBL4047764 0.88 CNR1 (0.64) CNR1CNR2NR3C1KDM4CROCK1

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 disclosed