SCHEMBL9879015

SCHEMBL9879015

Cc1ccccc1Nc1nc(C)c(C)c(=O)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
PDE9A O76083 2/20 0.54
STAT3 P40763 1/20 0.48
MAPT P10636 5/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HSP90AB1 P08238 1/20 0.48
GAA P10253 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48
BLM P54132 1/20 0.48
SAE1 Q9UBE0 1/20 0.48
UBA2 Q9UBT2 1/20 0.48
PABPC1 P11940 1/20 0.46
HTT P42858 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
LMNA P02545 2/20 0.44
XBP1 P17861 2/20 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
SCHEMBL9878162 0.80 MEN1 (0.52) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9879258 0.80 MAPT (0.62) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9878974 0.79 MEN1 (0.51) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9776663 0.79 KMT2A (0.65) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9879014 0.78 KMT2A (0.60) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9878449 0.76 MAPT (0.66) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9879379 0.75 MEN1 (0.64) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL9879486 0.75 KMT2A (1.00) KMT2AMEN1PDE9AMAPTALDH1A1
SCHEMBL637362 0.75 GDA (0.54)
SCHEMBL1553507 0.74 FGFR1 (0.52) KMT2AMEN1PDE9AMAPTALDH1A1

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