SCHEMBL31411974

SCHEMBL31411974

CCc1ncncc1-c1nc2ccc(C#N)cc2n1C1CC1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 20/20 0.69
▸ CYP11B1 P15538 17/20 0.69

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
SCHEMBL20337672 1.00 CYP11B2 (0.69) CYP11B2CYP11B1
SCHEMBL20337708 0.92 CYP11B2 (0.67) CYP11B2CYP11B1
SCHEMBL31412040 0.92 CYP11B2 (0.67) CYP11B2CYP11B1
SCHEMBL20337766 0.87 CYP11B2 (0.74) CYP11B2CYP11B1
SCHEMBL31412053 0.87 CYP11B2 (0.74) CYP11B2CYP11B1
SCHEMBL20337662 0.84 CYP11B1 (0.70) CYP11B2CYP11B1
SCHEMBL20337634 0.84 CYP11B2 (0.77) CYP11B2CYP11B1
SCHEMBL31411975 0.84 CYP11B2 (0.77) CYP11B2CYP11B1
SCHEMBL31411921 0.84 CYP11B1 (0.70) CYP11B2CYP11B1
SCHEMBL20337627 0.84 CYP11B2 (0.81) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3562306-B1 METALLOENZYME INHIBITOR COMPOUNDS JI XING PHARMACEUTICALS HONG KONG LTD (HK) 2025-02-26 — — EP claimed
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