SCHEMBL68764

SCHEMBL68764

O=C(O)c1cc(C(=O)O)n(-c2ccccc2)n1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 4/20 0.65
ALDH1A1 P00352 3/20 0.63
GAA P10253 1/20 0.63
GRN P28799 1/20 0.61
SORT1 Q99523 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.56
PPP1CA P62136 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MDM2 Q00987 4/20 0.52
MCL1 Q07820 3/20 0.52
BCL2 P10415 2/20 0.52
KDM4E B2RXH2 1/20 0.51
MARS1 P56192 1/20 0.48
SMN1; SMN2 Q16637 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
SCHEMBL28842592 0.86 RPA1 (0.52) RPA1ALDH1A1GAAGRNSORT1
SCHEMBL1143854 0.83 RPA1 (0.67) RPA1ALDH1A1L3MBTL1PPP1CAMEN1
SCHEMBL5402973 0.81 ALDH1A1 (0.63) RPA1ALDH1A1GAAGRNSORT1
SCHEMBL6173361 0.80 RPA1 (0.67) RPA1ALDH1A1GAAL3MBTL1MDM2
SCHEMBL1259093 0.80 ALDH1A1 (0.66) ALDH1A1GAAGRNSORT1KMT2A
SCHEMBL1259296 0.80 ALDH1A1 (0.64) RPA1ALDH1A1GAAL3MBTL1PPP1CA
SCHEMBL11418354 0.80 RPA1 (0.63) RPA1ALDH1A1L3MBTL1PPP1CAMEN1
SCHEMBL4993401 0.80 ALDH1A1 (0.61) RPA1ALDH1A1GAAGRNSORT1
SCHEMBL22897161 0.80 ALDH1A1 (0.61) RPA1ALDH1A1GAAGRNSORT1
SCHEMBL17369126 0.79 ALDH1A1 (0.59) RPA1ALDH1A1GAAGRNSORT1

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 RPA1 770/4885ALDH1A1 1882/4885GAA 1423/4885

“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.