SCHEMBL6172328

SCHEMBL6172328

CCN(CC)C(=O)Cn1c(=O)c(-c2ccc(OC)cc2)cc2c(OC)cc(OC)cc21

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSPO P30536 12/20 0.54
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 2/20 0.42
TP53 P04637 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 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
SCHEMBL6169951 0.90 TSPO (0.46) TSPOTDP1MEN1KMT2ANPC1
SCHEMBL6170009 0.86 EGLN1 (0.42)
SCHEMBL7813546 0.80 HDAC6 (0.41)
SCHEMBL6170913 0.80 KMO (0.48) MEN1KMT2ANPC1ALDH1A1LMNA
SCHEMBL6170872 0.78 TDP1 (0.46) TDP1NPC1ALDH1A1RAB9AKDM4E
SCHEMBL7199062 0.78 SMN1; SMN2 (0.49) MEN1KMT2ANPC1ALDH1A1LMNA
SCHEMBL7811933 0.78 EGLN1 (0.37) NPC1ALDH1A1MAPTRAB9ATP53
SCHEMBL6170787 0.77 DYRK1A (0.42) MEN1KMT2ANPC1ALDH1A1LMNA
SCHEMBL6170477 0.77 HASPIN (0.42) TDP1KMT2ANPC1ALDH1A1TSHR
SCHEMBL7257558 0.76 TSPO (0.45) TSPOTDP1MEN1KMT2ANPC1

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-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING 2-QUINOLONES LAFON LABOR (FR) 2005-12-07 EP disclosed
US-6593342-B1 Activity on the proliferation of clonogenic cells in tumours and comprising an efficient amount of a compound selected among the compounds LABORATOIRE L. LAFON (FR) 2003-07-15 US disclosed