SCHEMBL4667183

SCHEMBL4667183

Clc1ncccc1Br.Nc1ccc(Oc2ncccc2Br)nc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
POLB P06746 2/20 0.40
KEAP1 Q14145 1/20 0.39
ALDH1A1 P00352 1/20 0.39
BRCA1 P38398 1/20 0.39
HBB P68871 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RAB9A P51151 1/20 0.37
PDE10A Q9Y233 5/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
APAF1 O14727 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL581231 0.92 MEN1 (0.46) KDM4EMEN1KMT2APOLBKEAP1
SCHEMBL4669545 0.82 MEN1 (0.47) MEN1KMT2AALDH1A1RAB9APDE10A
SCHEMBL4234667 0.77 KMT2A (0.58) KDM4EMEN1KMT2APOLBKEAP1
SCHEMBL10271917 0.74 KEAP1 (0.59) KDM4EMEN1KMT2APOLBKEAP1
SCHEMBL122934 0.72
SCHEMBL29622282 0.72
SCHEMBL580112 0.71 MEN1 (0.56) MEN1KMT2AALDH1A1RAB9APDE10A
SCHEMBL4230135 0.71 KMT2A (0.58) KDM4EMEN1KMT2APOLBKEAP1
SCHEMBL14434735 0.70 KDM4E (0.46) KDM4EMEN1KMT2APOLBKEAP1
SCHEMBL15914773 0.70 KMT2A (0.66) KDM4EMEN1KMT2APOLBKEAP1

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-1984353-A1 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2008-10-29 EP disclosed
WO-2007087276-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2007-08-02 WO disclosed