SCHEMBL9068136

SCHEMBL9068136

CC(=O)/C(Cl)=N\Nc1cccc([N+](=O)[O-])c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.65
ALOX12 P18054 2/20 0.65
ALDH1A1 P00352 4/20 0.63
HPGD P15428 1/20 0.63
MEN1 O00255 9/20 0.60
KMT2A Q03164 9/20 0.60
RAB9A P51151 6/20 0.60
GAA P10253 2/20 0.60
MAPK1 P28482 2/20 0.60
SMN1; SMN2 Q16637 4/20 0.58
NPC1 O15118 6/20 0.55
NPSR1 Q6W5P4 2/20 0.55
POLB P06746 5/20 0.54
HTT P42858 3/20 0.54
DDX3X O00571 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
BLM P54132 2/20 0.50
RECQL P46063 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL9068138 1.00 MAPT (0.65) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL8590931 0.82 KMT2A (0.60) MAPTALOX12ALDH1A1MEN1KMT2A
SCHEMBL8590930 0.82 KMT2A (0.60) MAPTALOX12ALDH1A1MEN1KMT2A
SCHEMBL1465069 0.82 MAPT (0.67) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL1465068 0.82 MAPT (0.67) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL1465067 0.82 MAPT (0.67) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL8657109 0.80 MAPT (0.64) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL260595 0.79 MAPT (0.67) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL11997899 0.79 MAPT (0.67) MAPTALOX12ALDH1A1HPGDMEN1
SCHEMBL260597 0.79 MAPT (0.67) MAPTALOX12ALDH1A1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506228-A 2,6-diaryl pyridazinones with immunosuppressant activity MERCK & CO., INC. (US) 1996-04-09 US disclosed