SCHEMBL5669628

SCHEMBL5669628

NC1CCc2cccc3c2N(C1=O)[C@H](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
SCHEMBL3726276 1.00 ACE (0.58) ACEACE2MMESTAT3GZMB
SCHEMBL197902 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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1647279-A2 Inhibition of apoptosis using interleukin-1beta-converting enzyme (ICE)/CED-3 family inhibitors Idun Pharmaceuticals, Inc. (US) 2006-04-19 EP disclosed
EP-0929311-B1 INHIBITION OF APOPTOSIS USING INTERLEUKIN-1 beta-CONVERTING ENZYME (ICE)/CED-3 FAMILY INHIBITORS IDUN PHARMACEUTICALS INC (US) 2005-11-23 EP disclosed
US-20040058850-A1 Using caspase inhibitor; antiinflammatory agents IDUN PHARMACEUTICALS, INC. 2004-03-25 US disclosed
US-6693096-B2 SUPPRESSING PROTEASE ACTIVITY IDUN PHARMACEUTICALS, INC. 2004-02-17 US disclosed
US-20030186842-A1 Contacting a cell population with an inhibiting effective amount of a reagent that suppresses the protease activity of at least one member of the interleukin-1beta- converting enzyme (ICE)/CED-3 family IDUN PHARMACEUTICALS, INC. (US) 2003-10-02 US disclosed
US-6610683-B2 Programmed cell death; expansion of hematopoietic cells, for prolonging viability of an organ for transplantation, and maintaining viability of cell lines used in bioproduction IDUN PHARMACEUTICALS, INC. 2003-08-26 US disclosed
US-6531467-B2 Inhibition of inflammation using interleukin-1β-converting enzyme (ICE)/CED-3 family inhibitors IDUN PHARMACEUTICALS, INC. 2003-03-11 US disclosed
US-6528506-B2 Viability of organs transplants IDUN PHARMACEUTICALS, INC. 2003-03-04 US disclosed
US-20030039661-A1 Methods, compositions and kits for preserving antigenicity IDUN PHARMACEUTICALS, INC. 2003-02-27 US disclosed
US-20020147171-A1 Inhibition of apoptosis using interleukin-1beta converting enzyme (ICE)/CED-3 family inhibitors IDUN PHARMACEUTICALS, INC. (US) 2002-10-10 US disclosed
US-6444663-B2 TREATMENT OF PATIENTS SUFFERING INFLAMMATORY, AUTOIMMUNE AND NEURODEGENERATIVE DISEASES, AND FOR THE PREVENTION OF ISCHEMIC INJURY. IDUN PHARMACEUTICALS, INC. 2002-09-03 US disclosed
EP-0874850-B1 NOVEL TRICYCLIC COMPOUNDS FOR THE INHIBITION OF THE ICE/CED-3 PROTEASE FAMILY OF ENZYMES IDUN PHARMACEUTICALS INC (US) 2002-04-10 EP disclosed
US-20020016321-A1 Novel tricyclic compounds for the inhibition of the ICE/ced-3 protease family of enzymes KARANEWSKY DONALD S (US) 2002-02-07 US disclosed
US-20010044415-A1 Inhibition of apoptosis using interleukin-1B-converting enzyme (ICE)/CED-3 family inhibitors FRITZ LAWRENCE C (US) 2001-11-22 US disclosed
US-6200969-B1 CONTACTING CELLS WITH REAGENT WHICH SUPPRESSES PROTEASE ACTIVITY OF INTERLEUKIN-1.BETA.-CONVERTING ENZYME (ICE)/CED-3 FAMILY, INHIBITING APOPTOSIS IN CELL POPULATION TO EXPANDING OR INCREASING SURVIVAL OF CELL POPULATION IDUN PHARMACEUTICALS, INC. 2001-03-13 US disclosed
US-6187771-B1 Tricyclic compounds for the inhibition of the ICE/ced-3 protease family of enzymes IDUN PHARMACEUTICALS, INC. 2001-02-13 US disclosed
US-5968927-A AZEPINO-INDOLE COMPOUNDS; TREATMENT OF INFLAMMATORY, AUTOIMMUNE AND NEURODEGENERATIVE DISEASES, PREVENTION OF ISCHEMIC INJURY IDUN PHARMACEUTICALS, INC. (US) 1999-10-19 US disclosed
EP-0595610-B1 Benzo-fused lactams SQUIBB & SONS INC (US) 1997-05-07 EP disclosed
US-5504080-A Benzo-fused lactams BRISTOL-MYERS SQUIBB CO. (US) 1996-04-02 US disclosed
EP-0595610-A1 Benzo-fused lactams E.R. SQUIBB & SONS, INC. (US) 1994-05-04 EP 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 (6 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-20030186842-A1 Contacting a cell population with an inhibiting effective amount of a reagent that suppresses the protease activity of at least one member of the interleukin-1beta- converting enzyme (ICE)/CED-3 family CASP1, SERPINB1, IL1B ACE 70/4885ACE2 69/4885MME 91/4885
US-20030039661-A1 Methods, compositions and kits for preserving antigenicity CASP1, CASP3, APAF1 ACE 152/4885ACE2 392/4885MME 176/4885
US-20020147171-A1 Inhibition of apoptosis using interleukin-1beta converting enzyme (ICE)/CED-3 family inhibitors CASP1, CASP3, APAF1 ACE 74/4885ACE2 130/4885MME 205/4885
US-20040058850-A1 Using caspase inhibitor; antiinflammatory agents CASP1, PYCARD, CASP3 ACE 109/4885ACE2 164/4885MME 150/4885
US-20010044415-A1 Inhibition of apoptosis using interleukin-1B-converting enzyme (ICE)/CED-3 family inhibitors CASP1, IL1B, APAF1 ACE 117/4885ACE2 114/4885MME 305/4885
US-20020016321-A1 Novel tricyclic compounds for the inhibition of the ICE/ced-3 protease family of enzymes CASP3, CASP1, IDE ACE 432/4885ACE2 679/4885MME 375/4885

“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.