SCHEMBL14003191

SCHEMBL14003191

CCCCCCc1nc(C(=O)N[C@H](C(=O)CC)C(C)(C)C)c2n1CCCN(C)C2

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.50
CNR1 P21554 2/20 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
SCHEMBL1175811 0.90 CNR2 (0.63) CNR2
SCHEMBL1175813 0.90 CNR2 (0.63) CNR2
SCHEMBL1174700 0.89 CNR2 (0.64) CNR2
SCHEMBL1174699 0.89 CNR2 (0.64) CNR2
SCHEMBL14003193 0.88 CNR2 (0.55) CNR2CNR1
SCHEMBL1175127 0.82 CNR2 (0.67) CNR2CNR1
SCHEMBL1175125 0.82 CNR2 (0.67) CNR2CNR1
SCHEMBL1175063 0.81 CNR2 (0.64) CNR2CNR1
SCHEMBL1175067 0.81 CNR2 (0.64) CNR2CNR1
SCHEMBL14002134 0.81 CNR2 (0.53) CNR2

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-2008157751-A2 SUBSTITUTED IMIDAZOHETEROCYCLES CARA THERAPEUTICS, INC. (US) 2008-12-24 WO disclosed