SCHEMBL68855

SCHEMBL68855

CCOC(=O)c1cc(=O)cc(C(=O)OCC)o1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
AKR1B1 P15121 1/20 0.53
MAOB P27338 1/20 0.51
MAPK1 P28482 1/20 0.46
KDM4E B2RXH2 1/20 0.46
CA12 O43570 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
CA1 P00915 1/20 0.46
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
TSHR P16473 1/20 0.44
SLC2A1 P11166 1/20 0.44
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43

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
SCHEMBL11092361 0.81 TNKS (0.50) AKR1B1MAOBKDM4ETSHRALDH1A1
SCHEMBL449698 0.81 HDAC4 (0.73) HDAC4HDAC6AKR1B1MAOBKDM4E
SCHEMBL11079810 0.80 AKR1B1 (0.53) AKR1B1MAOBCA12CA2CA7
SCHEMBL11081404 0.79 EGFR (0.63) MAOBMAPK1KDM4ECA12CA2
SCHEMBL11088040 0.79 MAOB (0.54) MAOBALDH1A1LMNAMAPTNPC1
SCHEMBL11155635 0.79 LMNA (0.49) AKR1B1MAOBKDM4ESLC2A1ALDH1A1
SCHEMBL31571741 0.78 TAS1R3 (0.49) HDAC4HDAC6AKR1B1MAOBMAPK1
SCHEMBL28681713 0.78 TSHR (0.45) HDAC4HDAC6AKR1B1MAOBKDM4E
SCHEMBL11095573 0.78 CA12 (0.45) AKR1B1MAOBMAPK1KDM4ECA12
SCHEMBL11091748 0.78 AKR1B1 (0.40) HDAC4HDAC6AKR1B1MAOBMAPK1

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 7 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
US-4119775-A ANTIBACTERIAL RICHARDSON-MERRELL INC. (US) 1978-10-10 US disclosed
US-3989687-A ANTIBACTERIAL RICHARDSON-MERRELL INC. (US) 1976-11-02 US 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 HDAC4 211/4885HDAC6 572/4885AKR1B1 1027/4885

“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.