SCHEMBL14980902

SCHEMBL14980902

CN(C)c1ccc2c(c1)CCN(c1cccc(-c3cn(C)c(=O)c(N(C)c4ccc(C(=O)N5CCNCC5)cc4)n3)c1CO)C2=O

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 19/20 0.55

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
SCHEMBL3129200 0.89 BTK (0.70) BTK
SCHEMBL3131615 0.83 BTK (0.72) BTK
SCHEMBL3139251 0.81 BTK (0.79) BTK
SCHEMBL3134934 0.81 BTK (0.69) BTK
SCHEMBL1431535 0.81 BTK (0.69) BTK
SCHEMBL1431519 0.81 BTK (0.83) BTK
SCHEMBL1431576 0.78 BTK (0.70) BTK
SCHEMBL3131642 0.78 BTK (0.87) BTK
SCHEMBL14980892 0.78 BTK (0.59) BTK
SCHEMBL3128926 0.76 BTK (0.76) 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