SCHEMBL9848904

SCHEMBL9848904

CCCCc1nc(C)n(CCOCC)c(=O)c1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.42
PPARG P37231 1/20 0.41

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
SCHEMBL9848891 0.91 ACHE (0.45) ACHEPPARG
SCHEMBL1894209 0.90 ACHE (0.44) ACHE
SCHEMBL9848919 0.89 ACHE (0.46) ACHEPPARG
SCHEMBL1888706 0.86 SLC33A1 (0.45) ACHEPPARG
SCHEMBL4012560 0.86 PPARG (0.49) ACHEPPARG
SCHEMBL9848888 0.86
SCHEMBL1888296 0.86 ACHE (0.47) ACHEPPARG
SCHEMBL1892051 0.85 PPARG (0.51) ACHEPPARG
SCHEMBL1893223 0.84 PPARG (0.48) ACHEPPARG
SCHEMBL2845783 0.84 ACHE (0.43) ACHE

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-0435827-A2 Diaza compounds CIBA-GEIGY AG (CH) 1991-07-03 EP disclosed