⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7117147 | 0.84 | POLB (0.36) | — | |
| SCHEMBL7117148 | 0.84 | POLB (0.36) | — | |
| SCHEMBL12074783 | 0.79 | KDR (0.40) | — | |
| SCHEMBL21012218 | 0.75 | — | — | |
| SCHEMBL9696347 | 0.74 | PRKDC (0.41) | — | |
| SCHEMBL1163926 | 0.72 | — | — | |
| SCHEMBL225281 | 0.72 | — | — | |
| SCHEMBL8304851 | 0.70 | KDR (0.39) | — | |
| SCHEMBL8304853 | 0.70 | KDR (0.39) | — | |
| SCHEMBL9756842 | 0.70 | AKR1C3 (0.47) | — |
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 804 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113214182-A | Benzisothiazole compound and preparation method thereof | 佛山湘潭大学绿色智造研究院 | 2021-08-06 | — | — | CN | claimed |
| CN-112457289-A | Cyclopropyl thiophene methylamine compound or pharmaceutically acceptable salt thereof and application thereof | 横琴鲸准智慧医疗科技有限公司 | 2021-03-09 | — | — | CN | claimed |
| CN-108530466-A | A kind of polycyclic aromatic hydrocarbon organic semiconducting materials and its preparation method and application | 南京邮电大学 | 2018-09-14 | — | — | CN | claimed |
| CN-107930578-A | PERFORMANCE OF MODIFIED VERMICULITE adsorbent for benzene in Adsorption wastewater from chemical industry | 北京益清源环保科技有限公司 | 2018-04-20 | — | — | CN | claimed |
| CN-104370936-A | Novel pyruvate kinase M2 activator and its synthetic method | SUZHOU VIVOTIDE BIOTECHNOLOGIES CO LTD | 2015-02-25 | — | — | CN | claimed |
| CN-103694269-A | Compound for detecting secondary amine, and preparation and application thereof | SHANGHAI INST MICROSYS & INF | 2014-04-02 | — | — | CN | claimed |
| US-20070203138-A1 | Novel Compounds and Compositions as Cathepsin S Inhibitors | AVENTIS PHARMACEUTICALS INC. (US) | 2007-08-30 | — | — | US | claimed |
| CN-1324008-C | Novel compounds and compositions as cathepsin inhibitors | AVENTIS PHARMA INC (US) | 2007-07-04 | — | — | CN | claimed |
| US-20070135386-A1 | Novel Compounds and Compositions as Cathepsin Inhibitors | AVENTIS PHARMACEUTICALS INC. (US) | 2007-06-14 | — | — | US | claimed |
| US-7226921-B2 | Compounds and compositions as cathepsin S inhibitors | AVENTIS PHARMACEUTICALS INC. (US) | 2007-06-05 | — | — | US | claimed |
| US-20040192742-A1 | Novel compounds and compositions as cathepsin inhibitors | AVENTIS PHARMACEUTICALS INC. | 2004-09-30 | — | — | US | claimed |
| EP-1446392-A1 | OLIGOPEPTIDES AND COMPOSITIONS CONTAINING THEM AS CATHEPSIN S INHIBITORS | Aventis Pharmaceuticals, Inc. (US) | 2004-08-18 | — | — | EP | claimed |
| EP-1436255-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS | Aventis Pharmaceuticals, Inc. (US) | 2004-07-14 | — | — | EP | claimed |
| US-20030199506-A1 | Novel compounds and compositions as cathepsin S inhibitors | AXYS PHARMACEUTICALS INC. | 2003-10-23 | — | — | US | claimed |
| US-20030158231-A1 | Sulfonamide compounds as protease inhibitors | Celera Corporation | 2003-08-21 | — | — | US | claimed |
| WO-2003042197-A1 | OLIGOPEPTIDES AND COMPOSITIONS CONTAINING THEM AS CATHEPSIN S INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2003-05-22 | — | — | WO | claimed |
| WO-2003024924-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2003-03-27 | — | — | WO | claimed |
| WO-2003024923-A1 | SULFONAMIDE COMPOUNDS AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2003-03-27 | — | — | WO | claimed |
| US-4720550-A | Process for producing imidazolylthiophenaldehydes | A. NATTERMANN & CIE GMBH (DE) | 1988-01-19 | — | — | US | claimed |
| EP-0234350-A2 | Process for producing imidazolylthiophenaldehydes | A. Nattermann & Cie. GmbH (DE) | 1987-09-02 | — | — | EP | claimed |