SCHEMBL69045

SCHEMBL69045

O=C(Oc1ccccc1)c1cccnc1C(=O)Oc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.65
ALOX15 P16050 2/20 0.56
HSD17B10 Q99714 2/20 0.56
HPGD P15428 1/20 0.56
MAPT P10636 5/20 0.53
TDP1 Q9NUW8 4/20 0.53
KDM4E B2RXH2 3/20 0.53
LMNA P02545 2/20 0.51
TSHR P16473 2/20 0.50
CYP3A4 P08684 2/20 0.50
BLM P54132 1/20 0.50
AGER Q15109 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 1/20 0.46
NR4A2 P43354 1/20 0.44
TP53 P04637 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44

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
SCHEMBL8555721 0.89 ALDH1A1 (0.56) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL10900815 0.81 ALDH1A1 (0.63) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL10900355 0.81 ALDH1A1 (0.63) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL980115 0.81 ALDH1A1 (0.63) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL69868 0.79 HSD17B10 (0.76) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL29437924 0.79 HSD17B10 (0.76) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL27765083 0.79 ALDH1A1 (1.00) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL12948171 0.78 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10HPGDMAPT
SCHEMBL21937906 0.78 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10HPGDMAPT
Bicarbonate SCHEMBL27452806 0.77 HSD17B10 (0.73) ALDH1A1ALOX15HSD17B10HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US disclosed
CN-1934072-A Therapeutic and carrier molecules PEPLIN BIOLIPIDS PTY LTD (AU) 2007-03-21 CN disclosed
EP-1110992-B1 Solid polymer electrolyte having high-durability TOYOTA CHUO KENKYUSHO KK (JP) 2006-08-02 EP disclosed
US-6607856-B2 Solid polymer electrolyte having high-durability KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2003-08-19 US disclosed
US-20010038937-A1 Solid polymer electrolyte having high-durability KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2001-11-08 US disclosed
EP-1110992-A1 Solid polymer electrolyte having high-durability Kabushiki Kaisha Toyota Chuo Kenkyusho (JP) 2001-06-27 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 ALDH1A1 1882/4885ALOX15 1966/4885HSD17B10 2777/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.