SCHEMBL2201250

SCHEMBL2201250

NCCCCCC(N)(C(=O)OCc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1)C(=O)OCc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
KAT2B Q92831 2/20 0.36
CASP6 P55212 1/20 0.34
ALDH1A1 P00352 2/20 0.34
RAB9A P51151 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
APP P05067 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL2200690 0.84 RAB9A (0.46) MAPTALDH1A1RAB9A
SCHEMBL3612829 0.81 KAT2B (0.36) KAT2BALDH1A1KDM4E
SCHEMBL2201163 0.80 ALDH1A1 (0.35) MAPTALDH1A1KDM4EMEN1RECQL
SCHEMBL2201246 0.80 MC4R (0.37) MAPTKAT2BCASP6ALDH1A1RAB9A
SCHEMBL1130378 0.80 MAOB (0.44) MAPTKAT2BALDH1A1RAB9AMEN1
SCHEMBL29362035 0.80 MAOB (0.44) MAPTKAT2BALDH1A1RAB9AMEN1
SCHEMBL2200132 0.80 CYP1A2 (0.45) MAPTKAT2BALDH1A1KDM4EMEN1
SCHEMBL27736698 0.79 MAPT (0.40) MAPTCASP6ALDH1A1
SCHEMBL2197778 0.76 ADRB2 (0.35) MAPTKAT2BCASP6ALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL31300266 0.73 ALDH1A1 (0.44) ALDH1A1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1909142-B1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION ENHANCER TORAY INDUSTRIES (JP) 2015-06-24 EP disclosed
US-7977028-B2 Photosensitive resin composition and adhesion promoter TORAY INDUSTRIES, INC. (JP) 2011-07-12 US disclosed
US-20090123867-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION PROMOTER TORAY INDUSTRIES, INC. (JP) 2009-05-14 US disclosed
EP-1909142-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION ENHANCER TORAY INDUSTRIES, INC. (JP) 2008-04-09 EP 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-20090123867-A1 PHOTOSENSITIVE RESIN COMPOSITION AND ADHESION PROMOTER PCNA, TERB1, SMC2 MAPT 1072/4885KAT2B 400/4885CASP6 4346/4885

“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.