SCHEMBL5273581

SCHEMBL5273581

C=Cc1ccccc1CC(CCC)n1ccnc1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 14/20 0.46
▸ CYP17A1 P05093 5/20 0.44

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
SCHEMBL27807429 0.77 CYP19A1 (0.67) CYP19A1CYP17A1
SCHEMBL27831290 0.77 CYP19A1 (0.49) CYP19A1CYP17A1
SCHEMBL5295918 0.73 CYP19A1 (0.54) CYP19A1CYP17A1
SCHEMBL28192749 0.73 CYP19A1 (0.48) CYP19A1CYP17A1
Boric Acid SCHEMBL27962835 0.73 CYP19A1 (0.45) CYP19A1CYP17A1
SCHEMBL16163611 0.72 CYP17A1 (0.49) CYP19A1CYP17A1
SCHEMBL27547529 0.72 CYP19A1 (0.60) CYP19A1CYP17A1
SCHEMBL2518955 0.72 CYP17A1 (0.41) CYP19A1CYP17A1
SCHEMBL19122966 0.71 CYP17A1 (0.40) CYP19A1CYP17A1
Bromide SCHEMBL28301180 0.71 CYP17A1 (0.40) CYP19A1CYP17A1

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-1245401-B1 Ink jet recording element and printing method EASTMAN KODAK CO (US) 2007-11-28 — — EP claimed
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