SCHEMBL14715543

SCHEMBL14715543

COc1cc(OC)c(C(F)(F)F)cc1NC(=O)c1ccc(C)c(-c2nc(N)nc3ccccc23)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.49
KDR P35968 4/20 0.49
JAK3 P52333 4/20 0.49
MAPK14 Q16539 4/20 0.49
ADORA2A P29274 2/20 0.44
IGF1R P08069 2/20 0.43
TEK Q02763 1/20 0.42
PDE4D Q08499 1/20 0.41
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL14715533 0.84 ALDH1A1 (0.58) ADORA2AALDH1A1KDM4EADORA3MEN1
SCHEMBL14715462 0.84 ALDH1A1 (0.58) ADORA2AALDH1A1KDM4EGAAADORA3
SCHEMBL14715519 0.82 ADORA2A (0.50) LCKKDRJAK3MAPK14ADORA2A
SCHEMBL5488883 0.80 LCK (0.73) LCKKDRJAK3MAPK14TEK
SCHEMBL14715473 0.79 ADORA2A (0.45) LCKKDRJAK3MAPK14ADORA2A
SCHEMBL14715526 0.77 TAS1R3 (0.48) LCKKDRJAK3MAPK14ADORA2A
SCHEMBL14715491 0.76 MAPT (0.47) LCKKDRJAK3MAPK14ADORA2A
SCHEMBL14715517 0.76 POLB (0.58) ADORA2AALDH1A1MEN1KMT2AMAPT
SCHEMBL14715559 0.74 POLB (0.54) KDRTEKALDH1A1KDM4EGAA
SCHEMBL14715496 0.71 PLAU (0.53) LCKKDRJAK3MAPK14TEK

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-1836174-B2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2019-10-02 EP disclosed
EP-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP disclosed