SCHEMBL14980894

SCHEMBL14980894

CN(C)c1ccc2c(c1)CCN(c1cccc(-c3cn(C)c(=O)c(Nc4ccc5c(c4)N(N)C(=O)CC5)n3)c1CO)C2=O

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 19/20 0.61

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
SCHEMBL1431976 0.87 BTK (0.61) BTK
SCHEMBL1432420 0.86 BTK (0.66) BTK
SCHEMBL3143421 0.86 BTK (0.61) BTK
SCHEMBL3147167 0.85 BTK (0.64) BTK
SCHEMBL3143542 0.85 BTK (0.67) BTK
SCHEMBL3139137 0.84 BTK (0.60) BTK
SCHEMBL3131615 0.84 BTK (0.72) BTK
SCHEMBL3134955 0.84 BTK (0.63) BTK
SCHEMBL3147107 0.84 BTK (0.68) BTK
SCHEMBL3143694 0.84 BTK (0.68) BTK

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-2300459-B1 NOVEL PHENYLPYRAZINONES AS KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2013-05-29 EP disclosed