SCHEMBL14724558

SCHEMBL14724558

CBc1ccc2nc(N)ncc2c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LCK P06239 14/20 0.51
KDR P35968 7/20 0.51
JAK3 P52333 1/20 0.51
MAPK14 Q16539 1/20 0.51
CSNK1D P48730 1/20 0.46
CSNK1E P49674 1/20 0.46
CLK1 P49759 1/20 0.46
DYRK1A Q13627 1/20 0.46
KIT P10721 13/20 0.40
SRC P12931 13/20 0.40
BRAF P15056 2/20 0.37
EGFR P00533 1/20 0.35
FGFR1 P11362 1/20 0.35
MET P08581 1/20 0.34

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
SCHEMBL2632884 0.78 LCK (0.57) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL610225 0.78 EGFR (0.57) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL30912753 0.78 EGFR (0.57) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL14146496 0.77 KDM4E (0.49) LCKKDRJAK3MAPK14EGFR
Benzene SCHEMBL28800797 0.74 EGFR (0.53) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL28798252 0.74 BACE1 (0.55) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL46742 0.74 BACE1 (0.55) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL2130969 0.74 PIK3CG (0.53) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL27957917 0.74 KDR (0.49) LCKKDRJAK3MAPK14CSNK1D
SCHEMBL15679285 0.74 LCK (0.49) LCKKDRJAK3MAPK14CSNK1D

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-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP disclosed