SCHEMBL6309338

SCHEMBL6309338

CN(C)c1ccc(C=Cc2nc3cc(Cl)ccc3c(=O)n2CCCN)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
EGFR P00533 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
MAPT P10636 2/20 0.43
BLM P54132 6/20 0.43
LMNA P02545 3/20 0.42
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ABCC1 P33527 1/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
APP P05067 1/20 0.40

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
SCHEMBL6309335 1.00 MEN1 (0.57) MEN1KMT2AEGFRNPC1RAB9A
SCHEMBL6309356 0.92 MEN1 (0.57) MEN1KMT2ANPC1RAB9ARXFP1
SCHEMBL6309360 0.92 MEN1 (0.57) MEN1KMT2ANPC1RAB9ARXFP1
SCHEMBL7546935 0.87 MEN1 (0.60) MEN1KMT2AEGFRNPC1RAB9A
SCHEMBL7546931 0.87 MEN1 (0.60) MEN1KMT2AEGFRNPC1RAB9A
SCHEMBL6308082 0.86 MEN1 (0.77) MEN1KMT2ANPC1RAB9ARXFP1
SCHEMBL6308089 0.86 MEN1 (0.77) MEN1KMT2ANPC1RAB9ARXFP1
SCHEMBL6314623 0.83 MEN1 (0.58) MEN1KMT2AEGFRMAPTBLM
SCHEMBL6314628 0.83 MEN1 (0.58) MEN1KMT2AEGFRMAPTBLM
SCHEMBL6306210 0.82 KMT2A (0.51) MEN1KMT2ANPC1RAB9ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6890930-B1 Quinazolinones 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2005-05-10 US disclosed
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