SCHEMBL3726276

SCHEMBL3726276

NC1CCc2cccc3c2N(C1=O)C(C(=O)O)C3

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.58
ACE2 Q9BYF1 9/20 0.58
MME P08473 5/20 0.57
STAT3 P40763 1/20 0.43
GZMB P10144 1/20 0.41
AADAT Q8N5Z0 5/20 0.41
CASP1 P29466 1/20 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
SCHEMBL197902 1.00 ACE (0.58) ACEACE2MMESTAT3GZMB
SCHEMBL5669628 1.00 ACE (0.58) ACEACE2MMESTAT3GZMB
SCHEMBL12893385 1.00 ACE (0.58) ACEACE2MMESTAT3GZMB
SCHEMBL10331861 0.92 ACE (0.49) ACEACE2MME
SCHEMBL7278473 0.92 ACE (0.49) ACEACE2MME
SCHEMBL7278480 0.92 ACE (0.49) ACEACE2MME
SCHEMBL16804559 0.87 ACE (0.47) ACEACE2MMESTAT3GZMB
SCHEMBL7497338 0.85 ACE (0.49) ACEACE2MMESTAT3GZMB
SCHEMBL27015282 0.84 ACE (0.61) ACEACE2MMESTAT3GZMB
SCHEMBL14169787 0.82 ACE (0.45) ACEACE2MMESTAT3GZMB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11698375-B2 Method for producing an examination reagent and kit for analysing a T-cell frequency CONSTRUCTOR UNIVERSITY BREMEN GGMBH (DE) 2023-07-11 US disclosed
WO-2023087871-A1 GRANZYME B TARGETING COMPLEX, RADIOPHARMACEUTICAL, PREPARATION METHOD THEREFOR, AND USE THEREOF 北京大学 2023-05-25 WO disclosed
US-20190331681-A1 METHOD FOR PRODUCING AN EXAMINATION REAGENT AND KIT FOR ANALYSING A T-CELL FREQUENCY JACOBS UNIVERSITY BREMEN GGMBH (DE) 2019-10-31 US disclosed
US-10386367-B2 Method for producing an examination reagent and kit for analysing a T-cell frequency JACOBS UNIVERSITY BREMEN GGMBH (DE) 2019-08-20 US disclosed
US-9061069-B2 Use of constrained peptide mimic oligomers as vectorization agents CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-06-23 US disclosed
US-9061069-B2 Use of constrained peptide mimic oligomers as vectorization agents CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-06-23 US disclosed
US-20140370524-A1 METHOD FOR PRODUCING AN EXAMINATION REAGENT AND KIT FOR ANALYSING A T-CELL FREQUENCY JACOBS UNIVERSITY BREMEN GGMBH (DE) 2014-12-18 US disclosed
US-20120184480-A1 USE OF CONSTRAINED DIPEPTIDE AND TRIPEPTIDE MIMIC OLIGOMERS AS VECTORIZATION AGENTS UNIVERSITE DE MONTPELLIER I (FR) 2012-07-19 US disclosed
US-20120184480-A1 USE OF CONSTRAINED DIPEPTIDE AND TRIPEPTIDE MIMIC OLIGOMERS AS VECTORIZATION AGENTS UNIVERSITE DE MONTPELLIER I (FR) 2012-07-19 US disclosed
EP-2457896-A1 Tripeptides as caspase modulators Idun Pharmaceuticals, Inc. (US) 2012-05-30 EP disclosed
EP-2457895-A1 Tetrapeptide analogs Idun Pharmaceuticals, Inc. (US) 2012-05-30 EP disclosed
WO-2010118309-A2 INHIBITORS OF STAT3 AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-10-14 WO disclosed
US-20100190688-A1 Tetrapeptide analogs IDUN PHARMACEUTICALS, INC. 2010-07-29 US disclosed
EP-1773348-A4 TETRAPEPTIDE ANALOGS IDUN PHARMACEUTICALS INC (US) 2009-05-20 EP disclosed
EP-1773348-A2 TETRAPEPTIDE ANALOGS Idun Pharmaceuticals, Inc. (US) 2007-04-18 EP disclosed
WO-2006017295-A2 TETRAPEPTIDE ANALOGS IDUN PHARMACEUTICALS, INC. (US) 2006-02-16 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 (2 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-20120184480-A1 USE OF CONSTRAINED DIPEPTIDE AND TRIPEPTIDE MIMIC OLIGOMERS AS VECTORIZATION AGENTS DNPEP, IAPP, VIP ACE 167/4885ACE2 245/4885MME 28/4885
US-20100190688-A1 Tetrapeptide analogs TP53, PCNA, HRAS ACE 3012/4885ACE2 2991/4885MME 1097/4885

“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.