SCHEMBL20730156

SCHEMBL20730156

O=C(O)CCCOCCOCCCCCCCCOc1ccc(-c2ccn[nH]2)nc1

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 20/20 0.86
▸ CYP4A11 Q02928 20/20 0.86

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
SCHEMBL22070682 0.93 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL22070501 0.93 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL23309300 0.93 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL22098234 0.93 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL22098237 0.93 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL20730113 0.92 CYP4A11 (1.00) CYP4F2CYP4A11
SCHEMBL23309394 0.88 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL22098241 0.84 CYP4F2 (1.00) CYP4F2CYP4A11
SCHEMBL20730107 0.83 CYP4F2 (0.93) CYP4F2CYP4A11
SCHEMBL23309358 0.82 CYP4F2 (1.00) 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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