SCHEMBL9879088

SCHEMBL9879088

CCCc1cc(=O)[nH]c(Nc2ccccc2C)n1

nearest known ligand 0.75

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.75
NAMPT P43490 1/20 0.75
MAPT P10636 10/20 0.70
KMT2A Q03164 2/20 0.67
MEN1 O00255 1/20 0.67
SMN1; SMN2 Q16637 4/20 0.60
HTT P42858 3/20 0.60
LMNA P02545 1/20 0.60
POLB P06746 1/20 0.60
HSD17B10 Q99714 2/20 0.59
KDM4E B2RXH2 1/20 0.59
TP53 P04637 2/20 0.57
XBP1 P17861 2/20 0.57
HPGD P15428 1/20 0.57
ATM Q13315 1/20 0.57
MAPK1 P28482 2/20 0.53
PKM P14618 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CXCR2 P25025 1/20 0.52

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
SCHEMBL9879098 0.83 MEN1 (0.65) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9878068 0.83 MEN1 (0.65) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9879486 0.80 KMT2A (1.00) GAAMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL9879803 0.79 MEN1 (0.60) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9879083 0.79 MEN1 (0.56) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9879255 0.78 MEN1 (0.55) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9879392 0.78 KMT2A (0.74) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9878162 0.76 MEN1 (0.52) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9878159 0.76 MEN1 (0.52) GAANAMPTMAPTKMT2AMEN1
SCHEMBL9879258 0.76 MAPT (0.62) GAANAMPTMAPTKMT2AMEN1

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