SCHEMBL14980896

SCHEMBL14980896

Cn1cc(-c2cccc(N3CCc4cc(C5CC5)ccc4C3=O)c2CO)nc(Nc2cnn(CC(=O)P)c2)c1=O

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.85

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
SCHEMBL3143934 0.94 BTK (0.83) BTK
SCHEMBL1432650 0.93 BTK (0.88) BTK
SCHEMBL3138829 0.92 BTK (0.81) BTK
SCHEMBL3143279 0.92 BTK (0.87) BTK
SCHEMBL3143519 0.92 BTK (0.87) BTK
SCHEMBL3143502 0.92 BTK (1.00) BTK
SCHEMBL3144070 0.92 BTK (0.84) BTK
SCHEMBL3143417 0.91 BTK (0.85) BTK
SCHEMBL1432874 0.90 BTK (0.84) BTK
SCHEMBL3131519 0.90 BTK (0.77) 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