SCHEMBL9879083

SCHEMBL9879083

CCCc1cc(=O)nc(Nc2ccccc2C)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
GAA P10253 3/20 0.48
NAMPT P43490 1/20 0.48
MAPT P10636 5/20 0.44
PDE9A O76083 2/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
ADORA1 P30542 2/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
THRB P10828 1/20 0.42
BLM P54132 1/20 0.42
SAE1 Q9UBE0 1/20 0.42
UBA2 Q9UBT2 1/20 0.42
ADORA2A P29274 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
HSD17B10 Q99714 2/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL9879095 0.83 MEN1 (0.54) MEN1KMT2AGAAMAPTPDE9A
SCHEMBL9879379 0.80 MEN1 (0.64) MEN1KMT2AGAANAMPTMAPT
SCHEMBL9879088 0.79 GAA (0.75) MEN1KMT2AGAANAMPTMAPT
SCHEMBL9879255 0.78 MEN1 (0.55) MEN1KMT2AGAANAMPTMAPT
SCHEMBL9879390 0.78 MEN1 (0.61) MEN1KMT2AGAAMAPTPDE9A
SCHEMBL9879258 0.76 MAPT (0.62) MEN1KMT2AGAANAMPTMAPT
SCHEMBL9878162 0.76 MEN1 (0.52) MEN1KMT2AGAANAMPTMAPT
SCHEMBL9878159 0.76 MEN1 (0.52) MEN1KMT2AGAANAMPTMAPT
SCHEMBL2495430 0.76 MAPK1 (0.57) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL17226741 0.75 MAPT (0.49) MEN1KMT2AGAAMAPTKDM4E

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