SCHEMBL3154098

SCHEMBL3154098

Cc1ccc(C(=O)[N]C2CC2)cc1-n1cnc2c(-c3ccc(F)cc3)ncnc21

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.34
CYP46A1 Q9Y6A2 2/20 0.33
PI4KA P42356 1/20 0.33
PI4K2B Q8TCG2 1/20 0.33
PI4K2A Q9BTU6 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
MAPK14 Q16539 3/20 0.33
MAPK11 Q15759 2/20 0.33
TTK P33981 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3R1 P27986 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL3149867 0.89 MAPK14 (0.38) PI4KAPI4K2BPI4K2API4KBMAPK14
SCHEMBL3154106 0.84 MAPK14 (0.49) HTR7MAPK14MAPK11TTK
SCHEMBL3146393 0.76 MAPK14 (0.51) MAPK14
SCHEMBL3145456 0.75 MAPK14 (0.52) MAPK14
SCHEMBL3149778 0.75 MAPK14 (0.48) MAPK14
SCHEMBL3148658 0.74 MAPK14 (0.48) MAPK14
SCHEMBL3145425 0.73 MAPK14 (0.53) MAPK14MAPK11
SCHEMBL3138749 0.73 MAPK14 (0.47) MAPK14TTK
SCHEMBL3146079 0.73 MAPK14 (0.51) MAPK14MAPK11
SCHEMBL28762590 0.72 MAPK14 (0.46) MAPK14

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-1699800-B1 BICYCLIC HETEROCYCLIC P-38 KINASE INHIBITORS NOVARTIS AG (CH) 2010-02-10 EP disclosed