SCHEMBL9705657

SCHEMBL9705657

CCOC(=O)c1nc2cc(Cl)cc(Cl)c2[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 4/20 0.41
KDM4E B2RXH2 2/20 0.41
ALOX15 P16050 1/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
SIRT3 Q9NTG7 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
XBP1 P17861 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TLR9 Q9NR96 1/20 0.40
LMNA P02545 1/20 0.40
ADORA3 P0DMS8 2/20 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
SCHEMBL11366574 0.83 GLP1R (0.42) GLP1RMAPTALDH1A1NPC1LMNA
SCHEMBL9705025 0.80 GLP1R (0.44) GLP1RL3MBTL1MAPTKDM4EALOX15
SCHEMBL9703414 0.80 HTT (0.49) GLP1RL3MBTL1KDM4EALOX15HTT
SCHEMBL30623229 0.80 ADORA3 (0.55) GLP1RALOX15ALDH1A1HPGDSIRT2
SCHEMBL9704059 0.80 ADORA3 (0.55) GLP1RALOX15ALDH1A1HPGDSIRT2
SCHEMBL9703575 0.79 GRIN2D (0.63) GLP1RSIRT2SIRT1SIRT3HTT
SCHEMBL9704267 0.77 ALDH1A1 (0.41) GLP1RL3MBTL1MAPTKDM4EALDH1A1
SCHEMBL6377225 0.77 SIRT2 (0.56) ALOX15ALDH1A1SIRT2SIRT1SIRT3
SCHEMBL2315591 0.76 ALDH1A1 (0.55) L3MBTL1MAPTKDM4EALOX15ALDH1A1
SCHEMBL11258206 0.75 GRIN2D (0.51) GLP1RMAPTKDM4ESIRT2SIRT1

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