SCHEMBL3828183

SCHEMBL3828183

COC(=O)CCc1cncn1Cc1ccc(C)cc1

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 16/20 0.81
CYP11B2 P19099 16/20 0.81

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
SCHEMBL17544415 0.89 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL3822953 0.89 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL9642312 0.88 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL3819729 0.88 CYP11B2 (0.78) CYP11B1CYP11B2
SCHEMBL3825172 0.85 CYP11B1 (1.00) CYP11B1CYP11B2
SCHEMBL7981213 0.85 CYP11B1 (0.73) CYP11B1CYP11B2
SCHEMBL3821317 0.84 CYP11B1 (0.73) CYP11B1CYP11B2
SCHEMBL9642301 0.79 CYP11B1 (0.77) CYP11B1CYP11B2
SCHEMBL7713236 0.78 CYP11B1 (0.70) CYP11B1CYP11B2
SCHEMBL3822319 0.78 CYP11B1 (0.52) CYP11B1CYP11B2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009106640-A2 N-BENZYL IMIDAZOLE DERIVATIVES MAASTRICHT UNIVERSITY (NL) 2009-09-03 WO disclosed
EP-2095819-A1 N-benzyl imidazole derivatives and their use as aldosterone synthase inhibitors Maastricht University (NL) 2009-09-02 EP disclosed
EP-2095819-A1 N-benzyl imidazole derivatives and their use as aldosterone synthase inhibitors Maastricht University (NL) 2009-09-02 EP disclosed