SCHEMBL3264045

SCHEMBL3264045

[CH2]Cc1ccc(C2=NC(C)CN2)cc1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 4/20 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
SCHEMBL1627638 0.86 NISCH (0.37) NISCH
Hydrochloric Acid SCHEMBL1935364 0.80 MAOB (0.41) NISCH
SCHEMBL1884232 0.77 MEN1 (0.38) NISCH
SCHEMBL2491843 0.77 CYP3A4 (0.36) NISCH
SCHEMBL11835012 0.77 LMNA (0.44)
SCHEMBL108663 0.77 NISCH (0.47) NISCH
SCHEMBL1685395 0.74 NISCH (0.31) NISCH
SCHEMBL11826597 0.73 NISCH (0.50) NISCH
SCHEMBL9579786 0.72 NISCH (0.40) NISCH
SCHEMBL7008008 0.69 CYP2A6 (0.41)

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-2010020556-A1 NEW BRADYKININ B1 ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2010-02-25 WO disclosed