SCHEMBL9703434

SCHEMBL9703434

CCOC(=O)CC(=O)Nc1cc(Cl)cc(Cl)c1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
HPGD P15428 1/20 0.56
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 3/20 0.46
POLB P06746 1/20 0.45
ALDH1A1 P00352 7/20 0.44
TSHR P16473 1/20 0.44
PKM P14618 3/20 0.43
RECQL P46063 1/20 0.42
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL3706025 0.80 L3MBTL1 (0.69) MEN1HPGDKMT2AL3MBTL1MAPT
SCHEMBL9703477 0.80 MEN1 (0.50) MEN1HPGDKMT2AL3MBTL1MAPT
SCHEMBL9704149 0.80 HPGD (0.47) MEN1HPGDKMT2AL3MBTL1MAPT
SCHEMBL16564062 0.78 TSHR (0.58) MEN1KMT2AMAPTPOLBALDH1A1
SCHEMBL16564059 0.78 TSHR (0.58) MEN1KMT2AMAPTPOLBALDH1A1
SCHEMBL9704912 0.78 MAPT (0.51) MEN1KMT2AL3MBTL1MAPTPOLB
SCHEMBL9704920 0.78 MAPT (0.51) MEN1KMT2AL3MBTL1MAPTPOLB
SCHEMBL30623198 0.78 PKM (0.67) MEN1HPGDKMT2AL3MBTL1MAPT
SCHEMBL9703402 0.78 PKM (0.67) MEN1HPGDKMT2AL3MBTL1MAPT
SCHEMBL10631063 0.76 HPGD (0.72) MEN1HPGDKMT2AL3MBTL1MAPT

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
WO-1992011245-A1 2-ACYLAMIDO DERIVATIVES OF 3,4-DIHYDRO-3-OXO-QUINOXALINE HAVING PHARMACEUTICAL ACTIVITY WARNER-LAMBERT COMPANY (US) 1992-07-09 WO disclosed