SCHEMBL22687225

SCHEMBL22687225

O=C(Cc1ccccc1)N[C@@H](CO)C(=O)N[C@H]1CCc2cccc3c2N(C1=O)[C@H](C(=O)O)C3

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.68
ACE2 Q9BYF1 9/20 0.68
MME P08473 5/20 0.68
GZMB P10144 9/20 0.62

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
SCHEMBL22687046 0.93 ACE (0.73) ACEACE2MMEGZMB
SCHEMBL22687331 0.91 GZMB (0.72) ACEACE2MMEGZMB
SCHEMBL22687056 0.89 GZMB (0.73) ACEACE2MMEGZMB
SCHEMBL22687121 0.89 ACE (0.69) ACEACE2MMEGZMB
SCHEMBL22687101 0.88 ACE (0.67) ACEACE2MMEGZMB
SCHEMBL21274692 0.88 ACE (0.68) ACEACE2MMEGZMB
SCHEMBL22687249 0.88 ACE (0.65) ACEACE2MMEGZMB
SCHEMBL22687197 0.87 ACE (0.69) ACEACE2MMEGZMB
SCHEMBL22687284 0.87 GZMB (0.71) ACEACE2MMEGZMB
SCHEMBL22687169 0.86 GZMB (0.65) ACEACE2MMEGZMB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. (US) 2023-08-17 US disclosed
US-11667645-B2 Granzyme B directed imaging and therapy CYTOSITE BIOPHARMA INC. (US) 2023-06-06 US disclosed
US-20200369673-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. 2020-11-26 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 (3 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-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY GZMB, PRF1, CTSB ACE 1545/4885ACE2 1260/4885MME 289/4885
US-20200369673-A1 GRANZYME B DIRECTED IMAGING AND THERAPY GZMB, PRF1, CTSB ACE 1545/4885ACE2 1260/4885MME 289/4885
US-11667645-B2 Granzyme B directed imaging and therapy GZMB, PRF1, CTSB ACE 1545/4885ACE2 1260/4885MME 289/4885

“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.