SCHEMBL68516

SCHEMBL68516

COC(=O)c1ccc2oc3ccc(C(=O)OC)cc3c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA12 O43570 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
XDH P47989 1/20 0.53
CREBBP Q92793 1/20 0.53
PSMB8 P28062 1/20 0.51
MAPT P10636 3/20 0.50
NQO2 P16083 1/20 0.50
TNKS O95271 1/20 0.50
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 5/20 0.49
HPGD P15428 5/20 0.49
HSD17B10 Q99714 4/20 0.49
GLA P06280 1/20 0.49
GAA P10253 1/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49

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
SCHEMBL8954225 0.92 TNKS (0.58) MAPTTNKSKDM4EALDH1A1MEN1
SCHEMBL69937 0.91 NPC1 (0.58) CA1CA2CA12CA7CA9
SCHEMBL27143688 0.87 THRB (0.54) CA1CA2CA12CA7CA9
SCHEMBL23693559 0.86 TSHR (0.49) CA1CA2CA12CA7CA9
SCHEMBL11319698 0.85 KDM4E (0.56) CA1CA2CA12CA7CA9
SCHEMBL70757 0.85 CREBBP (0.57) CA1CA2CA12CA7CA9
SCHEMBL11319692 0.84 NPC1 (0.71) MAPTTNKSKDM4EALDH1A1HPGD
SCHEMBL29887160 0.83 TSHR (0.52) CA1CA2CA12CA7CA9
SCHEMBL29886891 0.83 TSHR (0.52) CA1CA2CA12CA7CA9
SCHEMBL23673548 0.83 TSHR (0.52) CA1CA2CA12CA7CA9

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 5 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

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 CA1 550/4885CA2 612/4885CA12 1221/4885

“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.