SCHEMBL5380284

SCHEMBL5380284

CCc1ccc(Nc2nc(=O)cc(-c3ccncc3)[nH]2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.44
MAPK14 Q16539 1/20 0.44
BUB1 O43683 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RAB9A P51151 2/20 0.42
MAPT P10636 3/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
XBP1 P17861 1/20 0.41
ATM Q13315 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
CDC7 O00311 2/20 0.40
NPC1 O15118 1/20 0.39
PIK3C3 Q8NEB9 1/20 0.38
ITK Q08881 1/20 0.38

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
SCHEMBL3825068 0.87 PIK3C3 (0.44) CDC7NPC1PIK3C3
SCHEMBL3827756 0.83 PIK3C3 (0.53) BUB1KMT2AMEN1SMN1; SMN2CDC7
SCHEMBL5380286 0.80 GSK3B (0.54) BUB1MAPTHTTSMN1; SMN2TP53
SCHEMBL3832211 0.79 CA1 (0.54) BUB1KMT2AMEN1NPC1
SCHEMBL5632811 0.76 SMN1; SMN2 (0.53) GCGRMAPK14KMT2AMEN1RAB9A
SCHEMBL5400013 0.75 NCOA1 (0.53) GCGRMAPK14BUB1KMT2AMEN1
SCHEMBL3830998 0.75 MEN1 (0.54) GCGRMAPK14BUB1KMT2AMEN1
SCHEMBL3847348 0.75 BUB1 (0.49) BUB1KMT2AMEN1RAB9AMAPT
SCHEMBL5632242 0.74 BUB1 (0.49) BUB1KMT2AMEN1MAPTHTT
SCHEMBL5399975 0.74 CDC7 (0.48) GCGRMAPK14SMN1; SMN2HPGDCDC7

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 claimed
US-7256199-B1 Pyrimidone derivatives MITSUBISHI CHEMICAL CORPORATION (JP) 2007-08-14 US disclosed