SCHEMBL6652306

SCHEMBL6652306

Cc1ccn(Cc2ccccc2)c(=O)c1Br

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.60
TP53 P04637 2/20 0.50
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP2D6 P10635 1/20 0.50
POLB P06746 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NOTUM Q6P988 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 2/20 0.46
BRD4 O60885 4/20 0.46
BRD2 P25440 1/20 0.46
BRD3 Q15059 1/20 0.46
BRDT Q58F21 1/20 0.46
ALDH1A1 P00352 1/20 0.46
VEGFA P15692 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44

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
SCHEMBL6652303 0.80 MAPK14 (0.60) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL4685054 0.80 MAPK14 (0.52) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL4392960 0.80 MAPK14 (0.60) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL4382314 0.78 MAPK14 (0.57) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL20873304 0.78 NOTUM (0.60) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL1137261 0.78 NOTUM (0.56) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL16509736 0.77 BRD4 (0.56) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL16479459 0.76 NOTUM (0.62) MAPK14TP53HTTSMN1; SMN2KDM4E
SCHEMBL4470415 0.75 MAPK14 (1.00) MAPK14HTTSMN1; SMN2MEN1KMT2A
SCHEMBL4489524 0.75 MAPK14 (0.55) MAPK14TP53HTTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490064-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE Pharmacia Corporation (US) 2004-12-29 EP claimed
WO-2003068230-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORPORATION (US) 2003-08-21 WO claimed
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed
EP-1490064-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE Pharmacia Corporation (US) 2004-12-29 EP disclosed
WO-2003068230-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORPORATION (US) 2003-08-21 WO disclosed