SCHEMBL68215

SCHEMBL68215

O=C(O)c1cc(C(=O)O)c2ncccc2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
LMNA P02545 2/20 0.50
ALOX12 P18054 1/20 0.50
PARP1 P09874 1/20 0.49
PDE4A P27815 2/20 0.48
KDM4E B2RXH2 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
PSMD14 O00487 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
KDM6B O15054 1/20 0.46
KDM6A O15550 1/20 0.46
TET3 O43151 1/20 0.46
KDM4A O75164 1/20 0.46
KDM4B O94953 1/20 0.46
KDM5C P41229 1/20 0.46
KDM4D Q6B0I6 1/20 0.46
TET2 Q6N021 1/20 0.46
ALKBH5 Q6P6C2 1/20 0.46
TET1 Q8NFU7 1/20 0.46
FTO Q9C0B1 1/20 0.46

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
SCHEMBL29089214 0.83 ALDH1A1 (0.54) ALDH1A1LMNAALOX12PARP1KDM4E
SCHEMBL11429773 0.83 ALDH1A1 (0.58) ALDH1A1LMNAALOX12PARP1KDM4E
SCHEMBL14305637 0.83 KDM4E (0.54) ALDH1A1LMNAALOX12PDE4AKDM4E
SCHEMBL30605381 0.83 ALDH1A1 (0.54) ALDH1A1LMNAALOX12PARP1KDM4E
SCHEMBL17092771 0.82 PDE4A (0.47) ALDH1A1LMNAALOX12PARP1PDE4A
SCHEMBL4602037 0.81 ALDH1A1 (0.53) ALDH1A1LMNAALOX12PARP1KDM4E
SCHEMBL8544466 0.81 ALDH1A1 (0.53) ALDH1A1LMNAALOX12PARP1KDM4E
SCHEMBL744645 0.81 ALDH1A1 (0.53) ALDH1A1LMNAALOX12PARP1PDE4A
SCHEMBL21816294 0.81 PSMD14 (0.56) ALDH1A1LMNAALOX12PARP1KDM4E
SCHEMBL23166686 0.81 PTPN6 (0.50) ALDH1A1LMNAPDE4APSMD14L3MBTL1

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 6 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-4968803-A FLUORINE AS OXIDANT ALLIED-SIGNAL INC. (US) 1990-11-06 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 1882/4885LMNA 2207/4885ALOX12 1847/4885

“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.