SCHEMBL7201466

SCHEMBL7201466

CC(=O)OC(C#N)C(NC(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 14/20 0.54
CTSL P07711 14/20 0.54
CTSB P07858 10/20 0.54
CTSK P43235 9/20 0.54
ELANE P08246 1/20 0.50
TACR1 P25103 1/20 0.48
ATM Q13315 1/20 0.47

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
SCHEMBL7201468 1.00 CTSS (0.54) CTSSCTSLCTSBCTSKELANE
SCHEMBL18662370 0.88 CTSS (0.54) CTSSCTSLCTSBCTSKELANE
SCHEMBL17275392 0.88 CTSS (0.54) CTSSCTSLCTSBCTSKELANE
SCHEMBL2226197 0.83 CTSS (0.59) CTSSCTSLCTSBCTSKELANE
SCHEMBL2226202 0.83 CTSS (0.59) CTSSCTSLCTSBCTSKELANE
SCHEMBL2226204 0.83 CTSS (0.59) CTSSCTSLCTSBCTSKELANE
SCHEMBL12906609 0.82 ATM (0.61) CTSSCTSLCTSBCTSKELANE
SCHEMBL7198750 0.81 ELANE (0.53) CTSSCTSLCTSBCTSKELANE
SCHEMBL7202814 0.81 ELANE (0.53) CTSSCTSLCTSBCTSKELANE
SCHEMBL8028649 0.81 ELANE (0.53) CTSSCTSLCTSBCTSKELANE

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6656910-B2 Serine protease inhibitors CORTECH, INC. 2003-12-02 US disclosed
US-6656911-B2 Oxadiazole ring structure peptoids which are useful as inhibitors of serine proteases CORTECH, INC. 2003-12-02 US disclosed
US-20030203851-A1 Substituted oxadiazole, peptoids which are useful for treating adult respiratory distress syndrome, septic shock and myocardial ischemia-reperfusion injury CORTECH, INC. 2003-10-30 US disclosed
US-6608175-B2 Oxadiazole, thiadiazoles or triazole metal derivatives reacted with an amine containing aldehyde, deprotecting, coupling with an acid and oxidizing to create substituted oxadiazole, thiadiazole or triazole peptoids CORTECH, INC. 2003-08-19 US disclosed
US-20030060418-A1 Serine protease inhibitors CORTECH, INC. 2003-03-27 US disclosed
US-20020119998-A1 Serine protease inhibitors CORTECH, INC. 2002-08-29 US disclosed
US-20020119985-A1 Serine protease inhibitors CORTECH, INC. 2002-08-29 US disclosed
US-6150334-A SUBSTITUTED OXADIAZOLE, THIADIAZOLE AND TRIAZOLE STRUCTURES WHICH ARE USEFUL AS INHIBITORS OF SERINE PROTEASES, INCLUDING HUMAN NEUTROPHIL ELASTASE CORTECH, INC. 2000-11-21 US disclosed
EP-0793674-B1 HUMAN NEUTROPHIL ELASTASE INHIBITORS CORTECH INC (US) 2000-05-24 EP disclosed
US-6037325-A CERTAIN SUBSTITUTED OXADIAZOLE, THIADIAZOLE AND TRIAZOLE PEPTOIDS USED EFFECTIVELY TO PREVENT, ALLEVIATE OR OTHERWISE TREAT DISEASE STATES CHARACTERIZED BY THE DEGRADATION OF CONNECTIVE TISSUE SUCH AS RESPIRATORY SYSTEM DISORDERS AND CORTECH, INC. (US) 2000-03-14 US disclosed
WO-1998049190-A9 SUBSTITUTED OXADIAZOLE CYSTEINE PROTEASE INHIBITORS CORTECH INC (US) 1999-04-15 WO disclosed
US-5891852-A Serine protease inhibitors-cycloheptane derivatives CORTECH, INC. (US) 1999-04-06 US disclosed
US-5874585-A TREATMENT AND/OR PREVENTION OF ELASTASE-MEDIATED PROBLEMS SUCH AS ARTHRITIS, PERIODONTAL DISEASE, GLOMERULONEPHRITIS, DERMATITIS, PSORIASIS, CYSTIC FIBROSIS, CHRONIC BRONCHITIS, ALZHEIMER'S DISEASE CORTECH, INC. (US) 1999-02-23 US disclosed
US-5869455-A SUBSTITUTED OXADIAZOLE, THIADIAZOLE AND TRIAZOLE PEPTOIDS WHICH ARE USEFUL AS INHIBITORS OF HUMAN NEUTROPHIL ELASTASE CORTECH, INC. (US) 1999-02-09 US disclosed
WO-1998049190-A2 SUBSTITUTED OXADIAZOLE CYSTEINE PROTEASE INHIBITORS CORTECH, INC. (US) 1998-11-05 WO disclosed
US-5807829-A RESPIRATORY SYSTEM DISORDERS; SESPIC SHOCK; ORGAN FAILURE CORTECH, INC. (US) 1998-09-15 US disclosed
US-5801148-A Serine protease inhibitors-proline analogs CORTECH, INC. (US) 1998-09-01 US disclosed
EP-0793674-A1 HUMAN NEUTROPHIL ELASTASE INHIBITORS CORTECH, INC. (US) 1997-09-10 EP disclosed
US-5618792-A USEFUL FOR TREATING ACUTE RESPIRATORY DISEASES, AND MYOCARDIAL ISHCEMIA-REPERFUSION INJURY CORTECH, INC. (US) 1997-04-08 US disclosed
WO-1996016080-A1 HUMAN NEUTROPHIL ELASTASE INHIBITORS CORTECH, INC. (US) 1996-05-30 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 (4 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-20020119985-A1 Serine protease inhibitors PRSS1, SERPINB1, SERPINE1 CTSS 106/4885CTSL 130/4885CTSB 353/4885
US-20030203851-A1 Substituted oxadiazole, peptoids which are useful for treating adult respiratory distress syndrome, septic shock and myocardial ischemia-reperfusion injury TNNI3, PEPD, STK35 CTSS 535/4885CTSL 782/4885CTSB 1831/4885
US-20030060418-A1 Serine protease inhibitors PRSS1, SERPINB1, SERPINE1 CTSS 106/4885CTSL 130/4885CTSB 353/4885
US-20020119998-A1 Serine protease inhibitors PRSS1, SERPINB1, SERPINE1 CTSS 106/4885CTSL 130/4885CTSB 353/4885

“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.