SCHEMBL4740958

SCHEMBL4740958

CC(C)(C)N(S)C(=O)Nc1ccc2ncc(-c3ccccc3)nc2n1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 19/20 0.66
MAPK14 Q16539 1/20 0.66
PIK3CA P42336 11/20 0.55
MAPK8 P45983 9/20 0.55
MAPK9 P45984 9/20 0.55
MAPK10 P53779 9/20 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
SCHEMBL4739063 0.87 MAPK1 (0.69) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL5445419 0.85 MAPK1 (0.77) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL4736471 0.84 MAPK1 (0.66) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL14506694 0.82 MAPK1 (0.74) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL5463710 0.82 MAPK1 (0.78) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL4734471 0.81 MAPK1 (0.64) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL4735763 0.81 MAPK1 (0.61) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL4786556 0.81 MAPK1 (0.67) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL5455879 0.81 MAPK1 (0.74) MAPK1MAPK14PIK3CAMAPK8MAPK9
SCHEMBL16673870 0.81 MAPK1 (0.67) MAPK1MAPK14PIK3CAMAPK8MAPK9

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-1962854-B1 PYRIDOPYRAZINE DERIVATIVES AND USE THEREOF AS MODULATORS OF THE SIGNAL TRANSDUCTION PATHS TERNA ZENTARIS GMBH (DE) 2015-05-06 EP claimed
EP-1636228-B1 NOVEL PYRIDOPYRAZINES AND USE THEREOF AS KINASE MODULATORS AETERNA ZENTARIS GMBH (DE) 2008-10-22 EP claimed