SCHEMBL6560581

SCHEMBL6560581

N#CCC(NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 12/20 0.64
CTSL P07711 12/20 0.64
CTSB P07858 7/20 0.64
CTSK P43235 5/20 0.64
TACR1 P25103 1/20 0.62
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53

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
SCHEMBL6560575 1.00 CTSS (0.64) CTSSCTSLCTSBCTSKTACR1
SCHEMBL4828679 0.86 CTSL (0.62) CTSSCTSLCTSBCTSKTACR1
SCHEMBL28723295 0.86 CTSL (0.62) CTSSCTSLCTSBCTSKTACR1
SCHEMBL6977400 0.86 TACR1 (0.55) CTSSCTSLCTSBCTSKTACR1
SCHEMBL29398507 0.86 TACR1 (0.55) CTSSCTSLCTSBCTSKTACR1
SCHEMBL7544219 0.85 CTSS (0.65) CTSSCTSLCTSBCTSKTACR1
SCHEMBL8552092 0.83 CTSS (0.63) CTSSCTSLCTSBCTSKTACR1
SCHEMBL8552093 0.83 CTSS (0.63) CTSSCTSLCTSBCTSKTACR1
SCHEMBL7372270 0.82 TACR1 (0.68) CTSSCTSLCTSBCTSKTACR1
SCHEMBL457686 0.82 PPARA (0.57) CTSSCTSLCTSBCTSKTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0998488-B1 POLYOL-AMINO ACID COMPOUNDS HAVING ANTI-HELICOBACTER PYLORI ACTIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-03-17 EP disclosed
US-6423869-B1 BACTERICIDES, ANTIULCER AGENTS TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 2002-07-23 US disclosed
US-5955576-A PEPTIDE ALDEHYDE ANALOGS THAT INHIBIT THROMBIN OR FACTOR XA; FOR PREVENTION OR TREATMENT OF ABNORMAL THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1999-09-21 US disclosed
EP-0684830-B1 INHIBITORS OF THROMBOSIS CORVAS INT INC (US) 1999-06-16 EP disclosed
US-5886146-A N-ACYLATED OR SULFONATED TRIPEPTIDES FROM PROLINE, ARGININE AND AMINO ACID WITH CARBOXY OR TETRAZOLE GROUP CORVAS INTERNATIONAL, INC. (US) 1999-03-23 US disclosed
EP-0627929-B1 INHIBITORS OF THROMBOSIS CORVAS INT INC (US) 1998-09-30 EP disclosed
EP-0684830-A4 INHIBITORS OF THROMBOSIS. CORVAS INT INC (US) 1996-04-17 EP disclosed
US-5492895-A PEPTIDE ALDEHYDE ANALOGS CORVAS INTERNATIONAL, INC. (US) 1996-02-20 US disclosed
EP-0684830-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1995-12-06 EP disclosed
EP-0627929-A4 INHIBITORS OF THROMBOSIS. CORVAS INT INC (US) 1995-07-12 EP disclosed
EP-0627929-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1994-12-14 EP disclosed
WO-1994017817-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1994-08-18 WO disclosed
WO-1993015756-A1 INHIBITORS OF THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 1993-08-19 WO disclosed