SCHEMBL20730060

SCHEMBL20730060

CC(C)(C=O)OCCCCCCCCOc1ccc(-c2ccn[nH]2)nc1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 20/20 0.71
▸ CYP4A11 Q02928 20/20 0.71

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
SCHEMBL23309192 1.00 CYP4F2 (0.71) CYP4F2CYP4A11
SCHEMBL20730109 0.84 CYP4F2 (0.73) CYP4F2CYP4A11
SCHEMBL22070549 0.83 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL23309467 0.83 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL22098443 0.81 CYP4F2 (0.68) CYP4F2CYP4A11
SCHEMBL20730334 0.80 CYP4F2 (0.68) CYP4F2CYP4A11
SCHEMBL20730075 0.80 CYP4F2 (0.68) CYP4F2CYP4A11
SCHEMBL22070573 0.79 CYP4F2 (0.77) CYP4F2CYP4A11
SCHEMBL23309255 0.79 CYP4F2 (0.98) CYP4F2CYP4A11
SCHEMBL20730290 0.79 CYP4F2 (0.67) CYP4F2CYP4A11

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-2019031618-A1 PYRIDINE COMPOUND SUBSTITUTED WITH AZOLE 大正製薬株式会社 2019-02-14 — — WO disclosed
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