SCHEMBL2879356

SCHEMBL2879356

COC(=O)c1cc(OC(=O)c2ccccc2)ccc1OC(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.69
MAPT P10636 5/20 0.56
KDM4E B2RXH2 1/20 0.56
POLB P06746 1/20 0.56
MAPK1 P28482 1/20 0.56
KMT2A Q03164 8/20 0.55
TDP1 Q9NUW8 2/20 0.55
MEN1 O00255 2/20 0.55
HSD17B10 Q99714 1/20 0.53
TSHR P16473 1/20 0.53
PRSS1 P07477 1/20 0.49
ACR P10323 1/20 0.49
ALDH1A1 P00352 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PKM P14618 1/20 0.49
PARP10 Q53GL7 1/20 0.47

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
SCHEMBL17304623 0.92 SLC6A3 (0.58) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL17304622 0.88 KMT2A (0.67) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL17304618 0.87 MAPT (0.55) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL20110389 0.87 MAPT (0.55) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL25270974 0.85 MAPT (0.53) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL17304624 0.85 MAPT (0.53) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL2877331 0.85 SLC6A3 (0.69) SLC6A3MAPTKDM4EPOLBMAPK1
SCHEMBL27375218 0.84 SLC6A3 (0.68) SLC6A3MAPTKDM4EMAPK1KMT2A
SCHEMBL2946505 0.84 SLC6A3 (0.68) SLC6A3MAPTKMT2AMEN1HSD17B10
SCHEMBL5695895 0.84 SLC6A3 (0.72) SLC6A3MAPTKDM4EPOLBKMT2A

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-2010043866-A2 HISTONE LYSINE DEMETHYLASE INHIBITORS ISIS INNOVATION LIMITED (GB) 2010-04-22 WO disclosed