SCHEMBL11155455

SCHEMBL11155455

O=C(CBr)Nc1cccc(Cl)c1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ MEN1 O00255 5/20 0.47
▸ LMNA P02545 3/20 0.46
▸ THRB P10828 1/20 0.42
▸ AGTR1 P30556 2/20 0.41
▸ POLB P06746 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL1917733 0.82 TSHR (0.51) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL4010958 0.78 MEN1 (0.77) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL5456482 0.77 KMT2A (0.68) KMT2AALDH1A1L3MBTL1MEN1POLB
SCHEMBL31146466 0.77 KMT2A (0.68) KMT2AALDH1A1L3MBTL1MEN1POLB
SCHEMBL18765136 0.77 TGM2 (0.48) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL11451542 0.76 MEN1 (0.54) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL17926417 0.76 ALDH1A1 (0.66) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL27905696 0.76 ALDH1A1 (0.41) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL28432763 0.76 MAPK1 (0.39) KMT2AALDH1A1L3MBTL1MAPTMAPK1
SCHEMBL4210079 0.75 LMNA (0.64) KMT2AALDH1A1L3MBTL1MAPTMAPK1

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
EP-0028609-B1 USE OF CHLORONITROPHENYL DERIVATIVES AS SELECTIVE HERBICIDES AND NEW CHLORONITROPHENYL DERIVATIVES SIEGFRIED AKTIENGESELLSCHAFT (CH) 1983-07-27 — — EP disclosed
EP-0028609-A1 Use of chloronitrophenyl derivatives as selective herbicides and new chloronitrophenyl derivatives. SIEGFRIED AG (CH) 1981-05-20 — — EP disclosed
WO-1980002493-A1 HERBICIDES SIEGFRIED AG (CH) 1980-11-27 — — WO disclosed
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