SCHEMBL7811936

SCHEMBL7811936

CCC(CC)(CC(N)=O)n1c(=O)c(-c2ccc(OC)cc2)cc2c(OC)cc(OC)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.38
KLK7 P49862 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP3A4 P08684 3/20 0.38
NPC1 O15118 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
EGLN1 Q9GZT9 3/20 0.36
TNFRSF1A P19438 1/20 0.36
BACE1 P56817 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
MPO P05164 1/20 0.35
TP53 P04637 2/20 0.34

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
SCHEMBL7811933 0.80 EGLN1 (0.37) RAB9AKLK7ALDH1A1CYP3A4NPC1
SCHEMBL6170009 0.75 EGLN1 (0.42) EGLN1
SCHEMBL6170922 0.75 ALDH1A1 (0.47) RAB9AKLK7ALDH1A1CYP3A4NPC1
SCHEMBL6170913 0.73 KMO (0.48) RAB9AKLK7ALDH1A1CYP3A4NPC1
SCHEMBL6172328 0.73 TSPO (0.54) RAB9AALDH1A1NPC1KDM4EMEN1
SCHEMBL6170872 0.72 TDP1 (0.46) RAB9AKLK7ALDH1A1CYP3A4NPC1
SCHEMBL6169951 0.71 TSPO (0.46) RAB9AALDH1A1NPC1KDM4EEGLN1
SCHEMBL6170787 0.70 DYRK1A (0.42) RAB9AKLK7ALDH1A1CYP3A4NPC1
SCHEMBL7197087 0.70 GRM2 (0.40) RAB9AKLK7ALDH1A1CYP3A4NPC1
SCHEMBL7199062 0.70 SMN1; SMN2 (0.49) ALDH1A1NPC1HSD17B10EGLN1TNFRSF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097138-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING 2-QUINOLONES LABORATOIRE L. LAFON (FR) 2001-05-09 EP claimed
WO-2000003990-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING 2-QUINOLONES LABORATOIRE L. LAFON (FR) 2000-01-27 WO claimed