⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12997358 | 0.67 | — | — | |
| SCHEMBL630634 | 0.65 | HDAC6 (0.41) | — | |
| SCHEMBL380666 | 0.63 | — | — | |
| SCHEMBL30659527 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL7988951 | 0.62 | HDAC6 (0.40) | — | |
| SCHEMBL28942535 | 0.61 | DAO (0.32) | — | |
| Hydrochloric Acid SCHEMBL3824245 | 0.61 | HDAC6 (0.48) | — | |
| SCHEMBL2851442 | 0.61 | — | — | |
| SCHEMBL6820045 | 0.61 | CYP1A2 (0.46) | — | |
| SCHEMBL5722550 | 0.60 | — | — |
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 472 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110684050-A | Preparation method and application of 7-position vinyl substituted osmium heteropentadiyne | 厦门大学 | 2020-01-14 | — | — | CN | claimed |
| EP-2611786-B1 | NEW COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODE PESTS | MONSANTO TECHNOLOGY LLC (US) | 2019-06-12 | — | — | EP | claimed |
| CN-106543232-B | Metal bridge location fused ring compound and its preparation method and application | 厦门大学 | 2019-01-11 | — | — | CN | claimed |
| EP-2396321-A2 | COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES | Divergence, Inc. (US) | 2011-12-21 | — | — | EP | claimed |
| EP-2389371-A2 | BUMETANIDE, FUROSEMIDE, PIRETANIDE, AZOSEMIDE, AND TORSEMIDE ANALOGS, COMPOSITIONS AND METHODS OF USE | Neurotherapeutics Pharma, Inc. (US) | 2011-11-30 | — | — | EP | claimed |
| WO-2010093650-A2 | COMPOSITIONS AND METHODS FOR CONTROLLING NEMATODES | DIVERGENCE, INC. (US) | 2010-08-19 | — | — | WO | claimed |
| WO-2010085352-A2 | BUMETANIDE, FUROSEMIDE, PIRETANIDE, AZOSEMIDE, AND TORSEMIDE ANALOGS, COMPOSITIONS AND METHODS OF USE | NEUROTHERAPEUTICS PHARMA, INC. (US) | 2010-07-29 | — | — | WO | claimed |
| WO-2005105777-A1 | SUBSTITUTED THIOPHENE AMIDE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA & UPJOHN COMPANY LLC (US) | 2005-11-10 | — | — | WO | claimed |
| EP-0749419-A1 | OXIME DERIVATIVES AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1996-12-27 | — | — | EP | claimed |
| EP-0439785-B1 | Substituted 2-[6-(pyrimidinyl)-indol-1-yl]-acrylic acid ester | BAYER AG (DE) | 1995-09-27 | — | — | EP | claimed |
| EP-0127992-B1 | CEPHALOSPORIN DERIVATIVES | ICI PHARMA (FR) | 1993-01-13 | — | — | EP | claimed |
| EP-0439785-A2 | Substituted 2-[6-(pyrimidinyl)-indol-1-yl]-acrylic acid ester | BAYER AG (DE) | 1991-08-07 | — | — | EP | claimed |
| US-4960880-A | STEREOSPECIFIC SYNTHESIS OF B-LACTAM INTERMEDIATES | SHIONOGI & CO., LTD. (JP) | 1990-10-02 | — | — | US | claimed |
| US-4855420-A | Cephalosporin derivatives | ICI PHARMA (FR) | 1989-08-08 | — | — | US | claimed |
| US-4678781-A | BACTERICIDAL ANTIBIOTICS | ICI PHARMA (FR) | 1987-07-07 | — | — | US | claimed |
| US-4614819-A | REACTING A THIOL ESTER COMPOUND WITH 7-AMINOCEPHALOSPORIN IN PRESENCE OF BORON TRIFLUORIDE | TOYAMA CHEMICAL CO., LTD. (JP) | 1986-09-30 | — | — | US | claimed |
| EP-0053893-B1 | DERIVATIVES OF CLAVULANIC ACID, THEIR PREPARATION AND THEIR USE | BEECHAM GROUP PLC (GB) | 1985-03-20 | — | — | EP | claimed |
| EP-0127992-A2 | Cephalosporin derivatives | ICI PHARMA (FR) | 1984-12-12 | — | — | EP | claimed |
| US-4438109-A | Tylosin derivatives | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1984-03-20 | — | — | US | claimed |
| US-4060687-A | Cephalosporins having a 3-α substituted alkyl grouping | MERCK & CO., INC. (US) | 1977-11-29 | — | — | US | claimed |