SCHEMBL28417865

SCHEMBL28417865

CC(=O)CC(=O)c1sccc1C(=O)c1ccco1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 5/20 0.44
MAPT P10636 2/20 0.44
MAPK10 P53779 1/20 0.44
POLB P06746 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
APEX1 P27695 1/20 0.44
RECQL P46063 1/20 0.44
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL8503933 0.79 KMT2A (0.50) KMT2AKDM4EMAPK1ALDH1A1MAPT
SCHEMBL183688 0.76 ERCC5 (0.65) KMT2AHSD17B10ALDH1A1MAPTPOLB
SCHEMBL28378821 0.75 ALDH1A1 (0.42) KMT2AKDM4EMAPK1HSD17B10ALDH1A1
SCHEMBL10356501 0.74 ERCC5 (0.62) KMT2AHSD17B10ALDH1A1MAPTPOLB
SCHEMBL10356158 0.74 ERCC5 (0.62) KMT2AHSD17B10ALDH1A1MAPTPOLB
Furan SCHEMBL27777911 0.70 ERCC5 (0.57) KMT2AMAPK1HSD17B10ALDH1A1MAPT
SCHEMBL6395918 0.70 ALDH1A1 (0.50) KMT2AKDM4EMAPK1HSD17B10ALDH1A1
SCHEMBL18103870 0.69 CES2 (0.54) KMT2AMAPK1HSD17B10ALDH1A1POLB
SCHEMBL5903882 0.68 GSK3B (0.65) KMT2APOLBRAB9ASMN1; SMN2L3MBTL1
SCHEMBL15546044 0.68 ALDH1A1 (0.44) KMT2AKDM4EMAPK1HSD17B10ALDH1A1

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
CN-106009788-B Coating liquid for forming coating film, method for producing same, and method for producing substrate with coating film 日挥触媒化成株式会社 2020-06-16 CN disclosed