SCHEMBL13416697

SCHEMBL13416697

O=C(O)CC(NC(=O)Oc1cccc(CCON(O)O)c1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TMPRSS15 P98073 3/20 0.44
ACHE P22303 6/20 0.40
BCHE P06276 4/20 0.40
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
MME P08473 1/20 0.38
CASP1 P29466 3/20 0.38

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
SCHEMBL13417085 0.94 TMPRSS15 (0.43) TMPRSS15ACHEBCHEGAAMAPT
SCHEMBL13416653 0.90 ACHE (0.40) ACHEBCHEMME
SCHEMBL13417046 0.89 NAALAD2 (0.44) ACHEBCHEGAA
SCHEMBL13416753 0.89 BCHE (0.47) ACHEBCHEMME
SCHEMBL13416301 0.87 FOLH1 (0.43) ACHEBCHEMME
SCHEMBL13416590 0.86 TMPRSS15 (0.41) TMPRSS15CASP1
SCHEMBL13416923 0.84 PRSS1 (0.44) ACHE
SCHEMBL13416885 0.84 FNTA (0.43)
SCHEMBL13417070 0.84 ACHE (0.46) ACHEBCHE
SCHEMBL13416575 0.83 ACHE (0.39) ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100099729-A1 NITRIC OXIDE DONOR COMPOUNDS NICOX S.A. (FR) 2010-04-22 US disclosed
WO-2008095841-A2 NITRIC OXIDE DONOR COMPOUNDS NICOX S.A. (FR) 2008-08-14 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-20100099729-A1 NITRIC OXIDE DONOR COMPOUNDS NOS3, NOS2, NOS1 TMPRSS15 2014/4885ACHE 540/4885BCHE 2693/4885

“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.