SCHEMBL11134848

SCHEMBL11134848

COCCCNS(=O)(=O)c1cc([N+](=O)[O-])cc(Br)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPK1 P28482 1/20 0.41
▸ PKM P14618 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ GSTO1 P78417 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ POLB P06746 3/20 0.38
▸ HTT P42858 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ LMNA P02545 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GAA P10253 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
SCHEMBL11773684 0.82 MAPK1 (0.47) ALDH1A1MAPK1PKML3MBTL1GSTO1
SCHEMBL11140253 0.76 MAPK1 (0.57) ALDH1A1MAPK1PKML3MBTL1MEN1
SCHEMBL11068177 0.74 ALDH1A1 (0.48) ALDH1A1PKML3MBTL1MEN1KMT2A
SCHEMBL12631870 0.73 MAPK1 (0.66) ALDH1A1MAPK1PKMMEN1KMT2A
SCHEMBL11809314 0.73 ALDH1A1 (0.56) ALDH1A1CYP3A4MEN1KMT2APOLB
SCHEMBL9349723 0.72 ALDH1A1 (0.59) ALDH1A1CYP3A4L3MBTL1MEN1KMT2A
SCHEMBL25592597 0.72 ALDH1A1 (0.62) ALDH1A1CYP3A4L3MBTL1POLBHTT
SCHEMBL11676296 0.70 POLB (0.49) ALDH1A1CYP3A4POLBHTTSMN1; SMN2
SCHEMBL11133671 0.69 ALDH1A1 (0.54) ALDH1A1CYP3A4PKMMEN1KMT2A
SCHEMBL13964436 0.68 ALDH1A1 (0.53) ALDH1A1CYP3A4POLBHTTLMNA

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-0039312-B1 COLOUR PHOTOPGRAPHIC MATERIAL FOR THE SILVER-DYE BLEACHING PROCESS, PROCESS FOR THE PRODUCTION OF THIS MATERIAL AND ITS USE IN THE PRODUCTION OF PHOTOGRAPHIC IMAGES CIBA-GEIGY AG (CH) 1983-12-28 — — EP disclosed
US-4379819-A OIL SOLUBLE MONOAZO DYE CIBA-GEIGY AG (CH) 1983-04-12 — — US disclosed
EP-0039312-A1 Colour photopgraphic material for the silver-dye bleaching process, process for the production of this material and its use in the production of photographic images CIBA-GEIGY AG (CH) 1981-11-04 — — EP disclosed
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