SCHEMBL20340176

SCHEMBL20340176

CC(C)NC(=O)CN1CCN(c2cc(-c3cc4ccc(F)cc4n3C3CC3)cnn2)CC1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 20/20 0.77
▸ CYP11B1 P15538 9/20 0.77

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
SCHEMBL31718011 0.87 CYP11B2 (1.00) CYP11B2CYP11B1
SCHEMBL20338212 0.87 CYP11B2 (1.00) CYP11B2CYP11B1
SCHEMBL20340129 0.86 CYP11B2 (0.76) CYP11B2CYP11B1
SCHEMBL18791093 0.81 CYP11B2 (0.66) CYP11B2CYP11B1
SCHEMBL20340058 0.78 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL20340033 0.77 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL18790700 0.75 CYP11B2 (0.56) CYP11B2CYP11B1
SCHEMBL20340087 0.74 CYP11B2 (0.71) CYP11B2CYP11B1
SCHEMBL18791021 0.73 CYP11B2 (0.69) CYP11B2CYP11B1
SCHEMBL20340229 0.73 CYP11B2 (0.71) 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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