⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10533757 | 1.00 | ALDH1A1 (0.46) | — | |
| SCHEMBL23753 | 0.97 | — | — | |
| SCHEMBL8088092 | 0.94 | — | — | |
| SCHEMBL17977839 | 0.94 | — | — | |
| SCHEMBL30753571 | 0.94 | — | — | |
| Hydrochlorthiazide SCHEMBL20873795 | 0.79 | ALDH1A1 (0.34) | — | |
| SCHEMBL7108032 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL11509016 | 0.76 | PDPK1 (0.32) | — | |
| Benzo[D]Thiazole SCHEMBL17796032 | 0.72 | ALDH1A1 (0.66) | — | |
| SCHEMBL7848 | 0.67 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6960629-B2 | Use of a metallic mercaptothiazole or metallic mercaptobenzothiazole in golf ball compositions | ACUSHNET COMPANY (US) | 2005-11-01 | — | — | US | claimed |
| US-20040230005-A1 | Use of a metallic mercaptothiazole or metallic mercaptobenzothiazole in golf ball compositions | ACUSHNET COMPANY | 2004-11-18 | — | — | US | claimed |
| US-7205344-B2 | Crosslinker for modified asphalt | GENERAL ELECTRIC COMPANY (US) | 2007-04-17 | — | — | US | disclosed |
| US-7045570-B2 | Liquid asphalt modifier | GENERAL ELECTRIC CO. (US) | 2006-05-16 | — | — | US | disclosed |
| US-6960629-B2 | Use of a metallic mercaptothiazole or metallic mercaptobenzothiazole in golf ball compositions | ACUSHNET COMPANY (US) | 2005-11-01 | — | — | US | disclosed |
| US-20050032942-A1 | Crosslinker for modified asphalt | GENERAL ELECTRIC COMPANY | 2005-02-10 | — | — | US | disclosed |
| US-20050032941-A1 | Liquid asphalt modifier | GENERAL ELECTRIC COMPANY | 2005-02-10 | — | — | US | disclosed |
| US-20040230005-A1 | Use of a metallic mercaptothiazole or metallic mercaptobenzothiazole in golf ball compositions | ACUSHNET COMPANY | 2004-11-18 | — | — | US | disclosed |
| US-6407152-B1 | HEATING AND CROSSLINKING THERMOPLASTIC ELASTOMER WITH THIOPOLYMER COMPRISING 4,4*-THIOBIS(6-TERT-BUTYL-M-CRESOL) PRODUCED FROM SULFUR DICHLORIDE AND 6-TERT-BUTYL-M-CRESOL | FINA TECHNOLOGY, INC. | 2002-06-18 | — | — | US | disclosed |
| US-6407152-B1 | HEATING AND CROSSLINKING THERMOPLASTIC ELASTOMER WITH THIOPOLYMER COMPRISING 4,4*-THIOBIS(6-TERT-BUTYL-M-CRESOL) PRODUCED FROM SULFUR DICHLORIDE AND 6-TERT-BUTYL-M-CRESOL | FINA TECHNOLOGY, INC. | 2002-06-18 | — | — | US | disclosed |