SCHEMBL8090726

SCHEMBL8090726

O=C(c1ccc(-c2ccccc2O)c(O)c1)c1ccc(-c2ccccc2O)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.51
HSD17B14 Q9BPX1 1/20 0.49
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FASN P49327 1/20 0.46
HSD17B1 P14061 1/20 0.45
HSD17B2 P37059 1/20 0.45
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
LIG1 P18858 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
BCL2L1 Q07817 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
PDK2 Q15119 1/20 0.42
TTR P02766 1/20 0.42

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
SCHEMBL6537037 0.85 TTR (0.60) TDP1L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL30015881 0.84 ATM (0.55) CNR2ATMTDP1L3MBTL1HSD17B1
SCHEMBL8011122 0.84 ATM (0.55) CNR2ATMTDP1L3MBTL1HSD17B1
SCHEMBL17196578 0.79 PTPRC (0.61) ATMTDP1L3MBTL1MEN1NPC1
SCHEMBL11814593 0.79 PTPRC (0.61) ATMTDP1L3MBTL1MEN1NPC1
Terephthalic Acid SCHEMBL9014425 0.77 TSHR (0.59) ALDH1A1HPGDBCL2L1HSD17B10TTR
Bicarbonate SCHEMBL6431103 0.76 ALDH1A1 (0.62) TDP1L3MBTL1MEN1NPC1RAB9A
SCHEMBL28574 0.75 ALDH1A1 (0.67) TDP1L3MBTL1MEN1NPC1RAB9A
SCHEMBL29623192 0.75 ALDH1A1 (0.67) TDP1L3MBTL1MEN1NPC1RAB9A
SCHEMBL30442890 0.75 ALDH1A1 (0.67) TDP1L3MBTL1MEN1NPC1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0637613-B1 RESIN COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2000-10-25 EP disclosed
US-5543474-A BLEND OF A AROMATIC POLYAMIDEIMIDE COPOLYMER AND A POLYESTER MITSUBISHI GAS COMPANY, INC. (JP) 1996-08-06 US disclosed
EP-0637613-A1 RESIN COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-02-08 EP disclosed