SCHEMBL28514409

SCHEMBL28514409

COc1c[nH]c(=O)cc1-c1cc(Cl)ccc1-n1cc(C#N)nn1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ F11 P03951 20/20 0.45
▸ KLKB1 P03952 18/20 0.45
▸ CYP3A4 P08684 2/20 0.40

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
SCHEMBL29479321 0.89 F11 (0.49) F11KLKB1CYP3A4
SCHEMBL21357358 0.89 F11 (0.49) F11KLKB1CYP3A4
SCHEMBL29227909 0.86 NOTUM (0.39) F11KLKB1
SCHEMBL30656620 0.85 F11 (0.40) F11KLKB1CYP3A4
SCHEMBL29089481 0.85 F11 (0.40) F11KLKB1CYP3A4
SCHEMBL29227926 0.85 P4HTM (0.38) F11KLKB1CYP3A4
SCHEMBL24633283 0.82 F11 (0.53) F11KLKB1CYP3A4
SCHEMBL21357414 0.82 F11 (0.51) F11KLKB1CYP3A4
SCHEMBL30325601 0.82 F11 (0.43) F11KLKB1CYP3A4
SCHEMBL28514407 0.80 F11 (0.43) F11KLKB1CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112028877-B Alkoxy pyridone compound and preparation method and application thereof 江西济民可信集团有限公司 2021-11-26 — — CN disclosed
CN-112028877-A Alkoxy pyridone compound and preparation method and application thereof 江西济民可信集团有限公司 2020-12-04 — — CN disclosed
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