SCHEMBL11031371

SCHEMBL11031371

CCOC(=O)CCCCCc1cccc(C#N)n1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 2/20 0.47
▸ CYP4A11 Q02928 2/20 0.47
▸ TBXAS1 P24557 1/20 0.46
▸ TOP2A P11388 2/20 0.42
▸ CES1 P23141 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ CYSLTR2 Q9NS75 2/20 0.41
▸ CYSLTR1 Q9Y271 2/20 0.41
▸ DAGLA Q9Y4D2 1/20 0.40
▸ FAAH O00519 2/20 0.39
▸ CYP4Z1 Q86W10 1/20 0.39
▸ PDE5A O76074 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ NAMPT P43490 1/20 0.38

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
SCHEMBL2958200 0.99 CYP4F2 (0.48) CYP4F2CYP4A11TBXAS1TOP2ACES1
SCHEMBL2954012 0.84 DAGLA (0.38) CYP4F2CYP4A11TOP2ACES1KCNH2
SCHEMBL22120171 0.79 KCNH2 (0.52) CES1KCNH2DAGLA
SCHEMBL7443875 0.79 CYP4F2 (0.51) CYP4F2CYP4A11TBXAS1TOP2AKCNH2
SCHEMBL9440177 0.78 KCNH2 (0.68) KCNH2
SCHEMBL2952437 0.78 KCNH2 (0.40) CYP4F2CYP4A11CES1KCNH2ALDH1A1
SCHEMBL3884465 0.77 CYP4F2 (0.48) CYP4F2CYP4A11TBXAS1TOP2ACYSLTR2
SCHEMBL11032626 0.76 CYP4F2 (0.45) CYP4F2CYP4A11TBXAS1TOP2AKCNH2
SCHEMBL6646352 0.75 CYP4F2 (0.56) CYP4F2CYP4A11TBXAS1CYSLTR2CYSLTR1
SCHEMBL15821166 0.75 CYP4F2 (0.46) CYP4F2CYP4A11TBXAS1TOP2ACYSLTR2

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-0068386-B1 SUBSTITUTED IMIDAZO(1,5-A)PYRIDINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THESE COMPOUNDS CIBA-GEIGY AG (CH) 1985-12-18 — — EP disclosed
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