SCHEMBL8710045

SCHEMBL8710045

CSc1sc2cc(Cl)ccc2c(=O)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.41
BCKDK O14874 1/20 0.41
MCL1 Q07820 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
GAA P10253 3/20 0.40
MEN1 O00255 2/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
TP53 P04637 1/20 0.39
LMNA P02545 2/20 0.38
PTGS2 P35354 2/20 0.38
NPSR1 Q6W5P4 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CMA1 P23946 1/20 0.37
TOP1 P11387 1/20 0.36
TOP2A P11388 1/20 0.36
DAO P14920 1/20 0.35

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
SCHEMBL12748045 0.71 KDM4E (0.61) MAPTKDM4EBCKDKMCL1RXFP1
SCHEMBL8285035 0.70 MCL1 (0.44) MAPTKMT2AKDM4EBCKDKMCL1
SCHEMBL1155667 0.69 KDM4E (0.80) MAPTKMT2AKDM4EBCKDKMCL1
SCHEMBL788639 0.69 NPSR1 (0.48) MAPTKMT2ABCKDKMCL1RXFP1
SCHEMBL4917246 0.68 MCL1 (0.40) MAPTKMT2AKDM4EBCKDKMCL1
SCHEMBL11661083 0.68 KDM4E (0.66) MAPTKMT2AKDM4EMCL1GAA
SCHEMBL4922527 0.68 BCKDK (0.53) MAPTKMT2AKDM4EBCKDKMCL1
SCHEMBL31228783 0.68 BCKDK (0.53) MAPTKMT2AKDM4EBCKDKMCL1
SCHEMBL16934958 0.67 MCL1 (0.42) MAPTKMT2AKDM4EBCKDKMCL1
SCHEMBL12153769 0.66 MCL1 (0.71) MAPTBCKDKMCL1RXFP1GAA

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-1998027080-A1 CHROMONES USEFUL AS FUNGICIDES AGREVO UK LIMITED (GB) 1998-06-25 WO disclosed