SCHEMBL9953155

SCHEMBL9953155

CNc1nc2ccc(Br)cc2c(=O)n1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 2/20 0.46
GABRA1 P14867 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
GABRA2 P47869 1/20 0.45
GABRA6 Q16445 1/20 0.45
HDAC1 Q13547 2/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 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
SCHEMBL9955183 0.84 CA12 (0.42) ALDH1A1MAPTHDAC1HDAC8HDAC6
SCHEMBL9954126 0.81 MAPT (0.43) ATMMEN1KMT2AALDH1A1RXFP1
SCHEMBL9954421 0.79 MEN1 (0.51) ATMMEN1KMT2AALDH1A1RXFP1
SCHEMBL9670140 0.79 MEN1 (0.51) ATMMEN1KMT2AALDH1A1RXFP1
SCHEMBL9953980 0.79 ATM (0.51) ATMMEN1KMT2AALDH1A1RXFP1
SCHEMBL3337074 0.78 PDE7A (0.63) ATMMEN1KMT2AALDH1A1RXFP1
SCHEMBL17643003 0.78 MEN1 (0.68) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL9953825 0.78 MAPT (0.48) MEN1KMT2AALDH1A1L3MBTL1MAPT
SCHEMBL23958174 0.77 MAPT (0.44) ATMMEN1KMT2AALDH1A1RXFP1
SCHEMBL9952990 0.76 KDM4E (0.52) MEN1KMT2AALDH1A1L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed