SCHEMBL10079171

SCHEMBL10079171

CCCCCCCCCCNC1=CC(=O)C(OC)=CC1=O

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 20/20 0.49
▸ MPEG1 Q2M385 5/20 0.46

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
SCHEMBL10936786 0.86 APAF1 (0.43) ALOX5
SCHEMBL9326771 0.85 ALDH1A1 (0.56) —
SCHEMBL15354650 0.79 ALDH1A1 (0.62) —
SCHEMBL20098762 0.76 ALDH1A1 (0.49) ALOX5MPEG1
SCHEMBL21814446 0.73 ACHE (0.51) —
SCHEMBL21814435 0.73 ACHE (0.51) —
SCHEMBL21814546 0.73 ACHE (0.51) —
SCHEMBL21814453 0.73 ACHE (0.51) —
SCHEMBL21814442 0.73 ACHE (0.51) —
SCHEMBL21818683 0.73 ACHE (0.51) —

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-2012022467-A2 NOVEL BENZOQUINONE DERIVATIVES AND USE THEREOF AS MODULATORS OF MITOCHONDRIAL FUNCTION SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2012-02-23 — — WO disclosed
Send feedback