SCHEMBL14837488

SCHEMBL14837488

CNC(=O)COc1ccc(Nc2cc(-c3ccc(C)c(-n4ccc5cc(N(C)C)ccc5c4=O)c3O)cn(C)c2=O)nc1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.49

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
SCHEMBL3211071 0.84 BTK (0.69) BTK
SCHEMBL14837477 0.79 BTK (0.51) BTK
SCHEMBL14837437 0.68 BTK (0.44) BTK
SCHEMBL1726330 0.67 BTK (0.85) BTK
SCHEMBL3207651 0.67 BTK (0.69) BTK
SCHEMBL3673714 0.66 BTK (0.79) BTK
SCHEMBL1725222 0.66 BTK (1.00) BTK
SCHEMBL3207086 0.66 BTK (0.81) BTK
SCHEMBL3143178 0.66 BTK (0.49) BTK
SCHEMBL1725376 0.66 BTK (0.86) 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-2242749-B1 NOVEL PYRIDINONES AND PYRIDAZINONES HOFFMANN LA ROCHE (CH) 2013-04-10 EP disclosed