SCHEMBL8219463

SCHEMBL8219463

Bc1ccc(CN2Cc3cncn3C(C(C)C)C2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 17/20 0.45
CYP11B1 P15538 17/20 0.45
CYP3A4 P08684 8/20 0.42
GRM2 Q14416 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32

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
SCHEMBL3977621 0.89 CYP11B1 (0.53) CYP11B2CYP11B1CYP3A4GRM2
SCHEMBL3975895 0.88 CYP11B2 (0.53) CYP11B2CYP11B1CYP3A4GRM2
SCHEMBL3975074 0.88 CYP11B2 (0.45) CYP11B2CYP11B1CYP3A4
SCHEMBL4088218 0.88 CYP11B1 (0.47) CYP11B2CYP11B1CYP3A4GRM2
SCHEMBL3981958 0.88 CYP11B2 (0.57) CYP11B2CYP11B1CYP3A4FNTAFNTB
SCHEMBL4082693 0.85 CYP11B2 (0.56) CYP11B2CYP11B1CYP3A4
SCHEMBL3977142 0.83 CYP11B2 (0.41) CYP11B2CYP11B1CYP3A4GRM2
SCHEMBL3976120 0.83 CYP11B2 (0.42) CYP11B2CYP11B1CYP3A4GRM2
SCHEMBL3980433 0.82 CYP11B1 (0.41) CYP11B2CYP11B1CYP3A4
SCHEMBL4094875 0.82 CYP11B2 (0.45) CYP11B2CYP11B1CYP3A4FNTAFNTB

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-2008027284-A1 FUSED IMIDAZOLE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY ALDOSTERONE SYNTHASE AND/OR 11-BETA-HYDROXYLASE AND/OR AROMATASE NOVARTIS AG (CH) 2008-03-06 WO disclosed