SCHEMBL16627833

SCHEMBL16627833

CCc1ccc(C(=O)n2c(=O)c(C(=O)NCc3ccc(Cl)cc3)cc3ccccc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
THRB P10828 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
POLA1 P09884 1/20 0.46
KDM4E B2RXH2 2/20 0.45
NPC1 O15118 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ABCB1 P08183 2/20 0.44
KCNH2 Q12809 1/20 0.44
F10 P00742 1/20 0.44
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL16627590 0.80 NPC1 (0.49) RXFP1MEN1KMT2AKDM4ENPC1
SCHEMBL16627696 0.80 LMNA (0.49) L3MBTL1THRBRXFP1MEN1KMT2A
SCHEMBL16627714 0.79 SMN1; SMN2 (0.43) TDP1L3MBTL1MEN1KMT2AKDM4E
SCHEMBL16627712 0.78 CNR1 (0.47) L3MBTL1MEN1KMT2AKDM4ENPC1
SCHEMBL16627881 0.78 SMN1; SMN2 (0.50) L3MBTL1MEN1KMT2AKDM4ENPC1
SCHEMBL16627883 0.78 SMN1; SMN2 (0.43) TDP1L3MBTL1RXFP1KDM4EHTT
SCHEMBL16627884 0.78 SMN1; SMN2 (0.43) TDP1L3MBTL1KDM4EALDH1A1HTT
SCHEMBL16627695 0.78 HTT (0.45) L3MBTL1MEN1KMT2AKDM4ENPC1
SCHEMBL16627882 0.75 KMT2A (0.43) RXFP1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL5441836 0.71 ELANE (0.54) TDP1L3MBTL1MEN1KMT2APOLA1

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