SCHEMBL8537240

SCHEMBL8537240

N#Cc1ccc(-c2ncc[nH]2)cc1F

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 16/20 0.48
CYP11B1 P15538 14/20 0.48
EGLN2 Q96KS0 3/20 0.46
NISCH Q9Y2I1 1/20 0.45

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
SCHEMBL8538740 0.83 NISCH (0.46) NISCH
SCHEMBL3978330 0.81 NISCH (0.45) NISCH
SCHEMBL1288737 0.80 NISCH (0.53) CYP11B2CYP11B1NISCH
SCHEMBL7425938 0.78 NISCH (0.45) NISCH
SCHEMBL28829248 0.76 NISCH (0.49) CYP11B2CYP11B1NISCH
SCHEMBL7060159 0.76 NISCH (0.49) NISCH
SCHEMBL18297999 0.75 CYP11B2 (0.67) CYP11B2CYP11B1
SCHEMBL5012098 0.75 PDE4A (0.44) NISCH
SCHEMBL9514239 0.73 CYP11B2 (0.54) CYP11B2CYP11B1EGLN2
SCHEMBL31605617 0.73 CYP11B2 (0.54) CYP11B2CYP11B1EGLN2

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
EP-0857171-A2 IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1998-08-12 EP disclosed
WO-1997015555-A2 IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 1997-05-01 WO disclosed