SCHEMBL6367888

SCHEMBL6367888

O=C(O)[C@@H]1CCCN1C(=O)C(O)CCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACE P12821 10/20 0.66
LMNA P02545 1/20 0.60
LTA4H P09960 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL5901033 0.86 ACE (0.66) ACELTA4H
SCHEMBL6435304 0.86 ACE (0.65) ACELMNALTA4H
SCHEMBL6435307 0.86 ACE (0.65) ACELMNALTA4H
SCHEMBL13111774 0.81 ACE (0.80) ACELMNASMN1; SMN2
SCHEMBL9554734 0.81 ACE (0.81) ACELTA4H
SCHEMBL9554742 0.81 ACE (0.81) ACELTA4H
SCHEMBL22702314 0.81 ACE (0.76) ACELMNASMN1; SMN2
SCHEMBL6787624 0.80 ACE (0.76) ACELTA4H
SCHEMBL6787617 0.80 ACE (0.76) ACELTA4H
Enalaprilat Anhydrous SCHEMBL24327564 0.79 ACE (1.00) ACELMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050026902-A1 Methods and compositions for the treatment or prevention of human immunodeficiency virus and related conditions using cyclooxygenase-2 selective inhibitors and antiviral agents PHARMACIA CORPORATION 2005-02-03 US 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-20050026902-A1 Methods and compositions for the treatment or prevention of human immunodeficiency virus and related conditions using cyclooxygenase-2 selective inhibitors and antiviral agents PTGS2, PTGS1, PTGES2 ACE 39/4885LMNA 3478/4885LTA4H 49/4885

“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.