SCHEMBL5380491

SCHEMBL5380491

Cc1c(-c2ccncc2)[nH]c(-c2ccccc2)nc1=O

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 16/20 0.60
MAPK12 P53778 16/20 0.60
MAPK11 Q15759 16/20 0.60
MAPK14 Q16539 16/20 0.60
RAF1 P04049 12/20 0.60
MAPK9 P45984 1/20 0.60
GSK3B P49841 1/20 0.52
GCGR P47871 4/20 0.52
BRAF P15056 2/20 0.52
ALOX5 P09917 1/20 0.52
IDO1 P14902 1/20 0.51
BRDT Q58F21 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50

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
SCHEMBL5383500 0.82 MAPK13 (0.60) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL5390319 0.82 MAPK13 (0.60) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL5382372 0.81 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL5380270 0.80 MAPK13 (0.51) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL5390448 0.79 MAPK13 (0.54) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL5381409 0.77 MAPK13 (0.55) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL5380497 0.76 POLB (0.85) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL7228717 0.76 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL2949385 0.76 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL11516210 0.75 MAPK13 (0.53) MAPK13MAPK12MAPK11MAPK14RAF1

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
US-7256199-B1 Pyrimidone derivatives MITSUBISHI CHEMICAL CORPORATION (JP) 2007-08-14 US disclosed
EP-1115721-B1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEM CORP (JP) 2003-12-10 EP disclosed