SCHEMBL10923959

SCHEMBL10923959

O=CC(Br)(c1ccccc1)c1ccc[n+]([O-])c1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
NR3C2 P08235 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
SCHEMBL1414647 0.79 ESR1 (0.41) MEN1KMT2A
SCHEMBL11075063 0.72 KMT2A (0.49) MEN1KMT2AL3MBTL1
SCHEMBL8813777 0.71 KIF11 (0.50) NR3C2
SCHEMBL5528030 0.71 ALDH1A1 (0.43) MEN1KMT2A
SCHEMBL5255832 0.70 ESR1 (0.59) MEN1KMT2A
SCHEMBL21495110 0.70 KIF11 (0.43) MEN1KMT2AL3MBTL1
SCHEMBL8796837 0.70 KIF11 (0.43) MEN1KMT2AL3MBTL1
SCHEMBL4015306 0.70 KCNN4 (0.50) MEN1KMT2AL3MBTL1
SCHEMBL909285 0.67 GPR84 (0.47) MEN1KMT2AL3MBTL1
SCHEMBL29689517 0.67 GPR84 (0.47) MEN1KMT2AL3MBTL1

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-0045081-B1 TRISUBSTITUTED IMIDAZOLE DERIVATIVES, PROCESSES FOR PREPARING THEM, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE CIBA-GEIGY AG (CH) 1986-01-08 EP disclosed
EP-0045081-A2 Trisubstituted imidazole derivatives, processes for preparing them, pharmaceutical compositions containing them, and their use CIBA-GEIGY AG (CH) 1982-02-03 EP disclosed