SCHEMBL7998919

SCHEMBL7998919

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

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.63
MEN1 O00255 8/20 0.50
KMT2A Q03164 8/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 3/20 0.48
RGS12 O14924 1/20 0.48
TYMS P04818 1/20 0.46
TP53 P04637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
HPGD P15428 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL7997204 0.88 NPC1 (0.57) NPC1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL7999762 0.87 NPC1 (0.56) NPC1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8004668 0.85 NPC1 (0.54) NPC1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL7998649 0.83 NPC1 (0.53) NPC1MEN1KMT2AKDM4ETYMS
SCHEMBL7997245 0.82 NPC1 (0.52) NPC1MEN1KMT2AKDM4ETYMS
SCHEMBL8004178 0.82 NPC1 (0.52) NPC1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8004493 0.82 NPC1 (0.52) NPC1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8004496 0.82 NPC1 (0.52) NPC1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL8000531 0.81 MEN1 (0.59) MEN1KMT2ASMN1; SMN2KDM4ETYMS
SCHEMBL8076784 0.81 NPC1 (0.50) NPC1MEN1KMT2ASMN1; SMN2TYMS

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 3 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