SCHEMBL16627895

SCHEMBL16627895

Cc1ccc(N(C)C(=O)c2cc3ccccc3[nH]c2=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
KDM4E B2RXH2 7/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
BRD4 O60885 1/20 0.51
MAPT P10636 1/20 0.49
HSD17B10 Q99714 1/20 0.49
RXFP1 Q9HBX9 2/20 0.47
MAOB P27338 1/20 0.46
TSHR P16473 2/20 0.45
DAO P14920 1/20 0.44
DDO Q99489 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
PADI4 Q9UM07 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
SCHEMBL3644717 0.91 MAOB (0.56) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL16627620 0.88 ALDH1A1 (0.49) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627851 0.86 MEN1 (0.46) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627840 0.86 MEN1 (0.46) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627847 0.84 ATM (0.50) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL16627846 0.84 KDM4E (0.50) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL16627718 0.84 MEN1 (0.64) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL7349368 0.82 BRD4 (0.53) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL17184560 0.78 KDM4E (0.46) MEN1KMT2AKDM4ELMNAGAA
SCHEMBL29206331 0.78 RXFP1 (0.57) MEN1KMT2AKDM4ELMNAGAA

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