SCHEMBL9954589

SCHEMBL9954589

Nc1nc2ccc(Br)cc2c(=O)n1-c1cccnc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 1/20 0.50
PI4KA P42356 4/20 0.46
PIK3CG P48736 3/20 0.46
KMT2A Q03164 3/20 0.46
RXFP1 Q9HBX9 2/20 0.46
MDM2 Q00987 1/20 0.46
MAPT P10636 2/20 0.43
RAB9A P51151 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRA6 Q16445 1/20 0.43
G6PD P11413 1/20 0.42
MEN1 O00255 2/20 0.42
ATM Q13315 1/20 0.42
PRNP P04156 1/20 0.42
PPARG P37231 1/20 0.42

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
SCHEMBL9953980 0.87 ATM (0.51) PI4KAPIK3CGKMT2ARXFP1MAPT
SCHEMBL9954470 0.84 HCAR1 (0.46) PI4KAPIK3CGKMT2ARXFP1MAPT
SCHEMBL9954543 0.82 ALDH1A1 (0.58) ALOX12KMT2ARXFP1MDM2MAPT
SCHEMBL10289024 0.78 SMN1; SMN2 (0.55) PI4KAPIK3CGKMT2AMAPTMEN1
SCHEMBL10288659 0.78 POLB (0.53) PI4KAPIK3CGKMT2AMAPTMEN1
SCHEMBL9953607 0.77 KMT2A (0.58) KMT2ARXFP1MAPTGABRA1GABRA5
SCHEMBL9954958 0.76 ALDH1A1 (0.47) KMT2AMAPTGABRA1GABRG2GABRB3
SCHEMBL16204870 0.75 KMT2A (0.58) KMT2ARXFP1RAB9AGABRA1GABRG2
SCHEMBL9955586 0.75 HPD (0.44) PI4KAPIK3CGKMT2AMEN1
SCHEMBL9954343 0.75 MAPT (0.49) KMT2AMAPTRAB9AMEN1ATM

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