SCHEMBL20340033

SCHEMBL20340033

Fc1ccc2cc(-c3cnnc(N4CCOCC4)c3)n(C3CC3)c2c1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 19/20 0.71
▸ CYP11B1 P15538 16/20 0.71
▸ PIK3CD O00329 1/20 0.42
▸ PIK3CB P42338 1/20 0.42

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
SCHEMBL20340058 0.89 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL20338211 0.83 CYP11B2 (1.00) CYP11B2CYP11B1
SCHEMBL20340012 0.82 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL20339921 0.80 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL20338177 0.80 CYP11B2 (1.00) CYP11B2CYP11B1
SCHEMBL20340221 0.80 CYP11B2 (0.74) CYP11B2CYP11B1
SCHEMBL20340129 0.79 CYP11B2 (0.76) CYP11B2CYP11B1
SCHEMBL20340053 0.77 CYP11B2 (0.70) CYP11B2CYP11B1
SCHEMBL20340102 0.77 CYP11B2 (0.70) CYP11B2CYP11B1
SCHEMBL20340231 0.77 CYP11B2 (0.70) CYP11B2CYP11B1

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-3562487-A2 METALLOENZYME INHIBITOR COMPOUNDS Selenity Therapeutics (Bermuda), Ltd. (BM) 2019-11-06 — — EP disclosed
WO-2018125800-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS (BERMUDA), LTD. (BM) 2018-07-05 — — WO disclosed
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