SCHEMBL5239596

SCHEMBL5239596

Cc1c(NC(=O)c2ccccc2)cccc1-c1cn2ccnc2c(Nc2ccc(C#N)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AURKA O14965 5/20 0.56
BTK Q06187 5/20 0.53
SYK P43405 9/20 0.51
ADORA3 P0DMS8 1/20 0.45
TMIGD3 P0DMS9 1/20 0.45

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
SCHEMBL1066489 0.92 BTK (0.60) AURKABTKSYK
SCHEMBL1068486 0.83 SYK (0.72) AURKABTKSYK
SCHEMBL1069035 0.81 AURKA (0.50) AURKASYK
SCHEMBL16716426 0.81 BTK (0.62) AURKABTKSYK
SCHEMBL12962408 0.81 BTK (0.60) AURKABTKSYK
SCHEMBL1068125 0.80 BTK (0.62) AURKABTKSYK
SCHEMBL12962452 0.80 BTK (0.50) AURKABTKSYK
SCHEMBL1066572 0.80 BTK (0.61) AURKABTKSYK
SCHEMBL12637975 0.79 BTK (0.60) AURKABTKSYK
SCHEMBL1066039 0.79 BTK (0.60) AURKABTKSYK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812442-A2 IMIDAZO[1,2-A]PYRAZIN-8-YLAMINES USEFUL AS MODULATORS OF KINASE ACTIVITY CGI Pharmaceuticals, Inc. (US) 2007-08-01 EP disclosed
WO-2006053121-A2 IMIDAZO[1 , 2-A] PYRAZIN-8-YLAMINES USEFUL AS MODULATORS OF KINASE ACTIVITY CGI PHARMACEUTICALS, INC. (US) 2006-05-18 WO disclosed