SCHEMBL7997204

SCHEMBL7997204

CCCCn1c(=O)c(O)c(OC)c2ccc(NC(C)=O)cc21

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.57
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
KDM4E B2RXH2 2/20 0.47
RGS12 O14924 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 1/20 0.40
TYMS P04818 1/20 0.40
PGR P06401 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
SCHEMBL7999762 0.90 NPC1 (0.56) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL8004668 0.89 NPC1 (0.54) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL7998919 0.88 NPC1 (0.63) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL7998649 0.87 NPC1 (0.53) NPC1MEN1KMT2AKDM4EMAPT
SCHEMBL8000796 0.87 NPC1 (0.54) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL8001268 0.87 MEN1 (0.52) NPC1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL8004493 0.86 NPC1 (0.52) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL8004496 0.86 NPC1 (0.52) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL7999350 0.83 NPC1 (0.51) NPC1MEN1KMT2AKDM4ERGS12
SCHEMBL7989064 0.83 NPC1 (0.51) NPC1MEN1KMT2AKDM4ERGS12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed