SCHEMBL5307764

SCHEMBL5307764

CCC(C(Cc1ccccc1)C(C)C)n1ccnc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 10/20 0.51
▸ CYP17A1 P05093 7/20 0.49
▸ CYP24A1 Q07973 1/20 0.45
▸ CYP26A1 O43174 1/20 0.42
▸ CYP11B1 P15538 1/20 0.41
▸ CYP11B2 P19099 1/20 0.41

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
SCHEMBL5294566 0.89 CYP17A1 (0.49) CYP19A1CYP17A1CYP24A1CYP26A1
SCHEMBL5303895 0.87 CYP19A1 (0.55) CYP19A1CYP17A1CYP24A1CYP26A1CYP11B1
SCHEMBL5283199 0.87 CYP17A1 (0.51) CYP19A1CYP17A1CYP24A1CYP26A1
SCHEMBL5296766 0.86 CYP17A1 (0.47) CYP19A1CYP17A1CYP24A1
SCHEMBL5289625 0.85 CYP17A1 (0.46) CYP19A1CYP17A1CYP24A1
SCHEMBL5287884 0.85 CYP17A1 (0.46) CYP19A1CYP17A1CYP24A1
SCHEMBL5288632 0.85 CYP17A1 (0.46) CYP19A1CYP17A1CYP24A1
SCHEMBL5281929 0.85 CYP17A1 (0.46) CYP19A1CYP17A1CYP24A1
SCHEMBL5291528 0.85 CYP17A1 (0.46) CYP19A1CYP17A1CYP24A1
SCHEMBL5818082 0.85 CYP17A1 (0.46) CYP19A1CYP17A1CYP24A1

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-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 — — WO disclosed
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