SCHEMBL5375207

SCHEMBL5375207

O=c1cc(-c2ccncc2)nc(Cc2ccc(Cl)cc2)[nH]1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 10/20 0.76
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.46
CDC7 O00311 2/20 0.45
ROCK2 O75116 2/20 0.45
MAP4K4 O95819 2/20 0.45
PIM1 P11309 2/20 0.45
PRKACA P17612 2/20 0.45
CDK2 P24941 2/20 0.45
HIPK2 Q9H2X6 2/20 0.45
CLK4 Q9HAZ1 2/20 0.45
MKNK2 Q9HBH9 2/20 0.45
IRAK4 Q9NWZ3 2/20 0.45
XDH P47989 1/20 0.45
MAPT P10636 1/20 0.44
GPR84 Q9NQS5 1/20 0.42
DYRK3 O43781 1/20 0.41
CDK1 P06493 1/20 0.41
CSF1R P07333 1/20 0.41

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
SCHEMBL5386996 0.88 GSK3B (0.78) GSK3BMEN1KMT2ASMN1; SMN2CDC7
SCHEMBL5376095 0.86 GSK3B (1.00) GSK3BMEN1KMT2ASMN1; SMN2CDC7
SCHEMBL5390457 0.84 GSK3B (0.72) GSK3BMEN1KMT2ASMN1; SMN2CDC7
SCHEMBL5382413 0.84 GSK3B (0.61) GSK3BMEN1KMT2ASMN1; SMN2ROCK2
SCHEMBL5381461 0.83 GSK3B (0.70) GSK3BMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL5382475 0.82 GSK3B (0.77) GSK3BMEN1KMT2ASMN1; SMN2XDH
SCHEMBL5386910 0.82 GSK3B (0.76) GSK3BMEN1KMT2ASMN1; SMN2CDC7
SCHEMBL5376074 0.80 GSK3B (0.78) GSK3BMEN1KMT2ASMN1; SMN2CDC7
SCHEMBL5380262 0.80 GSK3B (0.70) GSK3BMEN1KMT2ASMN1; SMN2CDC7
SCHEMBL5390697 0.79 GSK3B (0.76) GSK3BMEN1KMT2ASMN1; SMN2CDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115721-B1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEM CORP (JP) 2003-12-10 EP claimed
EP-1115721-A1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-18 EP claimed
WO-2000018758-A1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 2000-04-06 WO claimed
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
EP-1115721-A1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-18 EP disclosed
WO-2000018758-A1 PYRIMIDONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 2000-04-06 WO disclosed