SCHEMBL4729137

SCHEMBL4729137

Cc1cnc(NC(=O)C(C)(C)C2CC2)cc1CN1CCOCC1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.80
CNR1 P21554 8/20 0.76

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
SCHEMBL4732935 0.89 CNR2 (0.77) CNR2CNR1
SCHEMBL14206966 0.89 CNR2 (1.00) CNR2CNR1
SCHEMBL14207395 0.86 CNR2 (0.60) CNR2CNR1
SCHEMBL4730649 0.86 CNR2 (1.00) CNR2CNR1
SCHEMBL4734539 0.86 CNR2 (0.84) CNR2CNR1
SCHEMBL4735443 0.86 CNR2 (0.60) CNR2CNR1
SCHEMBL4780813 0.85 CNR2 (0.80) CNR2CNR1
SCHEMBL4730790 0.85 CNR2 (0.82) CNR2CNR1
SCHEMBL14206664 0.85 CNR2 (0.58) CNR2CNR1
SCHEMBL4733416 0.84 CNR2 (1.00) CNR2CNR1

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-2008063625-A2 PYRIDINE COMPOUNDS AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2008-05-29 WO claimed
WO-2008063625-A2 PYRIDINE COMPOUNDS AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2008-05-29 WO disclosed