SCHEMBL69748

SCHEMBL69748

O=C(O)c1ccc(C(=O)O)n1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.57
TSHR P16473 3/20 0.57
GAA P10253 3/20 0.47
NOTUM Q6P988 3/20 0.47
GSK3A P49840 5/20 0.45
GSK3B P49841 5/20 0.45
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
DAO P14920 2/20 0.42
NAPRT Q6XQN6 1/20 0.42
ALOX15 P16050 1/20 0.42
GRN P28799 1/20 0.42
SORT1 Q99523 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 1/20 0.40
MCL1 Q07820 1/20 0.39

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
SCHEMBL21363125 0.85 ALDH1A1 (0.55) ALDH1A1TSHRGAANOTUML3MBTL1
SCHEMBL27645641 0.83 ALDH1A1 (0.54) ALDH1A1TSHRGAAMAPK1L3MBTL1
SCHEMBL70120 0.76 TSHR (0.52) ALDH1A1TSHRGAANPSR1ALOX15
SCHEMBL6246846 0.73 NOTUM (0.54) ALDH1A1TSHRGAANOTUML3MBTL1
SCHEMBL30194196 0.73 ALDH1A1 (1.00) ALDH1A1TSHRDAOMCL1
SCHEMBL5208338 0.73 ALDH1A1 (1.00) ALDH1A1TSHRDAOMCL1
SCHEMBL16040506 0.72 ALDH1A1 (0.45) ALDH1A1TSHRGAANOTUMMAPK1
SCHEMBL27981446 0.71 ALDH1A1 (0.59) ALDH1A1TSHRGAANOTUMGSK3A
SCHEMBL28853825 0.71 ALDH1A1 (0.46) ALDH1A1TSHRGAANOTUMGSK3A
SCHEMBL27699296 0.70 ALDH1A1 (0.50) ALDH1A1TSHRGAAMAPK1L3MBTL1

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 ALDH1A1 1882/4885TSHR 3263/4885GAA 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.