SCHEMBL7549017

SCHEMBL7549017

CCN(CC)C(C)Cn1c(-c2ccccc2)nc2c(Cl)cc(Cl)cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44
BCL2 P10415 3/20 0.42
MCL1 Q07820 3/20 0.42
DPP4 P27487 3/20 0.40
EGFR P00533 1/20 0.40
LMNA P02545 2/20 0.39
KDM4E B2RXH2 2/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RECQL P46063 1/20 0.38
RAB9A P51151 1/20 0.38
CYP2C9 P11712 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL7546939 0.92 MEN1 (0.60) MEN1KMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL6309562 0.89 MEN1 (0.51) MEN1KMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL6306711 0.87 ALDH1A1 (0.51) MEN1KMT2AALDH1A1SMN1; SMN2BCL2
SCHEMBL6308049 0.85 KDM4E (0.57) MEN1KMT2AALDH1A1SMN1; SMN2DPP4
SCHEMBL6306748 0.84 MEN1 (0.50) MEN1KMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL6308095 0.83 MEN1 (0.51) MEN1KMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL6309074 0.81 MEN1 (0.48) MEN1KMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL6315697 0.81 MEN1 (0.63) MEN1KMT2AALDH1A1SMN1; SMN2FABP4
SCHEMBL6308133 0.80 MEN1 (0.43) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL6310577 0.80 ALDH1A1 (0.72) MEN1KMT2AALDH1A1SMN1; SMN2LMNA

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
EP-1216235-A1 QUINAZOLINONES MERCK PATENT GmbH (DE) 2002-06-26 EP disclosed
WO-2001023365-A1 QUINAZOLINONES MERCK PATENT GMBH (DE) 2001-04-05 WO disclosed