SCHEMBL9879392

SCHEMBL9879392

Cc1ccccc1Nc1nc(N)cc(=O)[nH]1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.74
MEN1 O00255 3/20 0.74
PABPC1 P11940 1/20 0.47
PDE9A O76083 2/20 0.46
GAA P10253 3/20 0.46
NAMPT P43490 1/20 0.46
MAPT P10636 3/20 0.46
BLM P54132 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
UBA2 Q9UBT2 1/20 0.46
HTT P42858 2/20 0.42
CYP3A4 P08684 1/20 0.42
C1R P00736 1/20 0.42
ATM Q13315 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
SCHEMBL9879486 0.85 KMT2A (1.00) KMT2AMEN1PDE9AGAAMAPT
SCHEMBL9879390 0.79 MEN1 (0.61) KMT2AMEN1PABPC1PDE9AGAA
SCHEMBL9879088 0.78 GAA (0.75) KMT2AMEN1GAANAMPTMAPT
SCHEMBL9878068 0.77 MEN1 (0.65) KMT2AMEN1GAANAMPTMAPT
SCHEMBL9879098 0.77 MEN1 (0.65) KMT2AMEN1PDE9AGAANAMPT
SCHEMBL9879379 0.76 MEN1 (0.64) KMT2AMEN1PABPC1PDE9AGAA
SCHEMBL9879803 0.73 MEN1 (0.60) KMT2AMEN1GAANAMPTMAPT
SCHEMBL9879014 0.73 KMT2A (0.60) KMT2AMEN1PABPC1PDE9AGAA
SCHEMBL9879015 0.73 KMT2A (0.60) KMT2AMEN1PABPC1PDE9AGAA
SCHEMBL15201247 0.72 KMT2A (0.68) KMT2AMEN1GAAMAPTKDM4E

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
WO-1991018887-A1 DIAMINOPYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM INTERCREDIT B.V. (NL) 1991-12-12 WO disclosed