SCHEMBL1483446

SCHEMBL1483446

CC(Cl)OC(=O)O[C@@H]1CO[C@H]2[C@@H]1OC[C@H]2OC(=O)N1CCC(O[N+](=O)[O-])CC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.42
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.38
ROCK2 O75116 1/20 0.34
ROCK1 Q13464 1/20 0.34
PRSS1 P07477 1/20 0.31
TPSG1 Q9NRR2 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
SCHEMBL1483457 1.00 BCHE (0.42) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL1483452 1.00 BCHE (0.42) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL10030647 0.83 BCHE (0.59) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL10030646 0.83 BCHE (0.59) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL12829089 0.83 BCHE (0.39) BCHEPRSS1TPSG1
SCHEMBL637594 0.82 MAPT (0.59) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL637595 0.82 MAPT (0.59) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL1551375 0.81 BCHE (0.40) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL1551373 0.81 BCHE (0.40) BCHEMAPTALDH1A1ROCK2ROCK1
SCHEMBL637892 0.76 CYP1A2 (0.46) BCHE

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-2313417-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS Nicox S.A. (FR) 2011-04-27 EP disclosed
US-20110077279-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS NICOX S.A. (FR) 2011-03-31 US disclosed
US-20110077279-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS NICOX S.A. (FR) 2011-03-31 US disclosed
WO-2009150007-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS NICOX S.A. (FR) 2009-12-17 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-20110077279-A1 ANGIOTENSIN II RECEPTOR ANTAGONISTS AGTR1, AGTR2, AGT BCHE 2032/4885MAPT 3856/4885ALDH1A1 2089/4885

“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.