SCHEMBL2200690

SCHEMBL2200690

NCCCCCC(N)(C(=O)OCc1ccc([N+](=O)[O-])cc1)C(=O)OCc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
IDO1 P14902 2/20 0.46
MAOB P27338 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
AKR1C3 P42330 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
HTR2A P28223 1/20 0.41
GAA P10253 1/20 0.41
MC4R P32245 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
SCHEMBL2201250 0.84 MAPT (0.36) RAB9AALDH1A1MAPT
SCHEMBL2200132 0.82 CYP1A2 (0.45) ALDH1A1MAPTGAA
SCHEMBL2201163 0.81 ALDH1A1 (0.35) ALDH1A1MAPTHTT
SCHEMBL3612829 0.79 KAT2B (0.36) MAOBALDH1A1HTT
Hydrochloric Acid SCHEMBL31300266 0.79 ALDH1A1 (0.44) ALDH1A1
SCHEMBL10515527 0.79 TSHR (0.47) LOXL2ALDH1A1GAAMC4R
SCHEMBL2200685 0.79 MC4R (0.48) RAB9AIDO1MAOBLOXL2AKR1C3
SCHEMBL1130378 0.78 MAOB (0.44) RAB9AMAOBALDH1A1MAPTHTT
SCHEMBL29362035 0.78 MAOB (0.44) RAB9AMAOBALDH1A1MAPTHTT
SCHEMBL2203139 0.77 MMP2 (0.40) ALDH1A1MAPTGAAMC4R

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 RAB9A 2276/4885IDO1 3470/4885MAOB 2649/4885

“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.