SCHEMBL16627718

SCHEMBL16627718

CCN(C(=O)c1cc2ccccc2[nH]c1=O)c1ccc(C)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
KDM4E B2RXH2 7/20 0.58
LMNA P02545 2/20 0.58
GAA P10253 1/20 0.58
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
TSHR P16473 1/20 0.51
MAPT P10636 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
BRD4 O60885 1/20 0.48
HPGD P15428 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
RXFP1 Q9HBX9 2/20 0.47
RECQL P46063 1/20 0.47
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL16627777 0.91 SMN1; SMN2 (0.58) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627596 0.90 KMT2A (0.52) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627893 0.89 KMT2A (0.51) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627842 0.89 KMT2A (0.51) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627838 0.89 KMT2A (0.51) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627597 0.86 KMT2A (0.48) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627849 0.85 ALDH1A1 (0.57) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627895 0.84 MEN1 (0.58) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL34468718 0.80 KDM4E (0.62) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL7349368 0.76 BRD4 (0.53) MEN1KMT2AKDM4ELMNAALDH1A1

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-2015050379-A1 NOVEL QUINOLINONE DERIVATIVE AND USE THEREOF 광주과학기술원 2015-04-09 WO disclosed