SCHEMBL68531

SCHEMBL68531

CC=Cc1cc(O)c(OC)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.55
CYP3A4 P08684 2/20 0.53
HMGCR P04035 1/20 0.53
MAOB P27338 1/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TTR P02766 1/20 0.41
APP P05067 1/20 0.41
RECQL P46063 1/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
RAB9A P51151 1/20 0.40
ALOX5 P09917 2/20 0.40
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
TUBB1 Q9H4B7 3/20 0.40
NFE2L2 Q16236 1/20 0.40

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
SCHEMBL68530 1.00 TYR (0.55) TYRCYP3A4HMGCRMAOBALDH1A1
SCHEMBL3486261 0.88 HMGCR (0.70) TYRCYP3A4HMGCRMAOBALDH1A1
SCHEMBL11451337 0.82 CNR2 (0.44) TYRCYP3A4HMGCRALDH1A1KDM4E
SCHEMBL11451338 0.82 CNR2 (0.44) TYRCYP3A4HMGCRALDH1A1KDM4E
SCHEMBL16389630 0.82 CNR2 (0.44) TYRCYP3A4HMGCRALDH1A1KDM4E
SCHEMBL22361000 0.82 CYP3A4 (0.52) TYRCYP3A4HMGCRALDH1A1KDM4E
SCHEMBL28763191 0.81 HMGCR (0.55) TYRCYP3A4HMGCRMAOBALDH1A1
SCHEMBL14798025 0.78 CYP3A4 (0.51) TYRCYP3A4HMGCRKDM4EMAPT
SCHEMBL6234401 0.78 ERN1 (0.53) TYRALDH1A1KDM4ECA1CA2
SCHEMBL69624 0.78 MAOB (0.59) TYRCYP3A4HMGCRMAOBALDH1A1

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 TYR 134/4885CYP3A4 2028/4885HMGCR 3448/4885

“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.