SCHEMBL70055

SCHEMBL70055

O=[N+]([O-])c1cc(Br)cc(Cc2cc(Br)cc([N+](=O)[O-])c2O)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.57
SNCA P37840 2/20 0.56
GPR35 Q9HC97 6/20 0.46
ALDH1A1 P00352 5/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP2C9 P11712 2/20 0.44
HIF1A Q16665 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP2D6 P10635 1/20 0.44
CASP1 P29466 1/20 0.44
CYP2C19 P33261 1/20 0.44
KDM4E B2RXH2 2/20 0.43
RECQL P46063 2/20 0.43
TTR P02766 1/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL14151904 0.86 ERN1 (0.54) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL4144580 0.84 ERN1 (0.69) ERN1GPR35ALDH1A1MAPTMEN1
SCHEMBL3640209 0.83 ERN1 (0.59) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL16345283 0.82 ERN1 (0.54) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL2771860 0.82 ERN1 (0.50) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL19327235 0.80 ERN1 (0.57) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL68433 0.79 GPR35 (0.63) SNCAGPR35ALDH1A1MAPTMEN1
SCHEMBL16097264 0.79 ERN1 (0.51) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL12946484 0.79 ERN1 (0.48) ERN1SNCAGPR35ALDH1A1MAPT
SCHEMBL17456081 0.79 ERN1 (0.51) ERN1SNCAGPR35ALDH1A1MAPT

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 ERN1 3196/4885SNCA 3983/4885GPR35 2050/4885

“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.