SCHEMBL396354

SCHEMBL396354

CC(CCCCOC(=O)O)O[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.35
PTGS1 P23219 2/20 0.35
MAPT P10636 2/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
FAAH O00519 1/20 0.30

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
SCHEMBL396353 1.00 PTGS2 (0.35) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL15135362 1.00 PTGS2 (0.35) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL15135361 0.88 MAPT (0.34) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL396352 0.88 MAPT (0.34) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL16914737 0.88 PTGS2 (0.37) PTGS2PTGS1
SCHEMBL3400690 0.83 ALDH1A1 (0.39) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL13001173 0.80 MAPT (0.30) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL3400688 0.80 MAPT (0.30) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL13000821 0.80 MAPT (0.30) PTGS2PTGS1MAPTCRHBPCRHR2
SCHEMBL3404736 0.80 MAPT (0.30) PTGS2PTGS1MAPTCRHBPCRHR2

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-2274279-B1 NITRIC OXIDE DONATING PROSTAMIDES NICOX SA (FR) 2013-07-31 EP disclosed
US-8101658-B2 Nitric oxide donating prostamides NICOX S.A. (FR) 2012-01-24 US disclosed
US-20110092590-A1 NITRIC OXIDE DONATING PROSTAMIDES NICOX S.A. (FR) 2011-04-21 US disclosed
EP-2274279-A1 NITRIC OXIDE DONATING PROSTAMIDES Nicox S.A. (FR) 2011-01-19 EP disclosed
WO-2009136281-A1 NITRIC OXIDE DONATING PROSTAMIDES NICOX S.A. (FR) 2009-11-12 WO 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-20110092590-A1 NITRIC OXIDE DONATING PROSTAMIDES PTGIS, PTGIR, NOS2 PTGS2 6/4885PTGS1 4/4885MAPT 4448/4885

“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.