⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL104811 | 0.83 | APP (0.32) | — | |
| SCHEMBL2344274 | 0.75 | CYP2A6 (0.50) | — | |
| SCHEMBL3149415 | 0.73 | MMP3 (0.38) | — | |
| SCHEMBL5986844 | 0.73 | CYP2A6 (0.57) | — | |
| SCHEMBL20015760 | 0.73 | CYP2A6 (0.57) | — | |
| SCHEMBL1246271 | 0.73 | CYP2A6 (0.57) | — | |
| SCHEMBL10789402 | 0.71 | — | — | |
| Bicarbonate SCHEMBL11402475 | 0.71 | TSHR (0.35) | — | |
| SCHEMBL9677273 | 0.71 | CYP2A6 (0.38) | — | |
| SCHEMBL18508 | 0.71 | — | — |
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
Appears in 4174 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118271331-A | Gelsemin derivatives, synthesis method and application thereof in inhibiting tumor cell proliferation | 赣江中药创新中心 | 2024-07-02 | — | — | CN | claimed |
| CN-115485268-B | Synthesis of vinyl protected alcohol intermediates | 安进公司 | 2024-06-18 | — | — | CN | claimed |
| CN-118159542-A | Substituted 2, 3-dihydro [1,3] thiazolo [4,5-b ] pyridines, salts thereof and their use as herbicidal agents | 拜耳公司 | 2024-06-07 | — | — | CN | claimed |
| US-20240116939-A1 | CHIRAL OR RACEMIC PYRIMIDINE-FUSED DIAZEPINONE DERIVATIVES, PREPARATION METHOD, AND APPLICATION THEREOF | SUN YAT-SEN UNIVERSITY (CN) | 2024-04-11 | — | — | US | claimed |
| CN-115368363-B | Chiral or racemized pyrimidodiazepinone compound and preparation method and application thereof | 中山大学 | 2024-02-20 | — | — | CN | claimed |
| US-20240033318-A1 | PEPTIDYL INHIBITORS OF CALCINEURIN-NFAT INTERACTION | OHIO STATE INNOVATION FOUNDATION | 2024-02-01 | — | — | US | claimed |
| US-11844846-B2 | Styrylbenzothiazole derivatives and uses in imaging methods | EMORY UNIVERSITY (US) | 2023-12-19 | — | — | US | claimed |
| CN-114805286-B | Preparation method of naphthoxythiazepine derivative | 深圳职业技术学院 | 2023-06-16 | — | — | CN | claimed |
| US-20230183164-A1 | Synthesis of Vinyl Cyclobutyl Intermediates | AMGEN INC. (US) | 2023-06-15 | — | — | US | claimed |
| US-20230174496-A1 | Synthesis of Vinylic Protected Alcohol Intermediates | AMGEN INC. (US) | 2023-06-08 | — | — | US | claimed |
| WO-1991012250-A1 | NOVEL ANTIVIRAL AND ANTITUMOR TERPENE HYDROQUINONES AND METHODS OF USE | HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) | 1991-08-22 | — | — | WO | claimed |
| US-4912231-A | Reacting a proline derivative with an aromatic nucleophile in presence of a Lewis acid catalyst | E. R. SQUIBB & SONS, INC. (US) | 1990-03-27 | — | — | US | claimed |
| US-4868241-A | POLYVINYL ALCOHOL MODIFIED WITH BENZOIC ACID DERIVATIVE | AMERICAN CYANAMID COMPANY (US) | 1989-09-19 | — | — | US | claimed |
| EP-0231922-A2 | Electron beam and X-ray resists | AMERICAN CYANAMID COMPANY (US) | 1987-08-12 | — | — | EP | claimed |
| EP-0041043-B1 | PROCESS FOR THE PREPARATION OF DERIVATIVES OF ALKENYL BENZENE OR ALKENYL NAPHTHALENE | CIBA-GEIGY AG (CH) | 1983-11-09 | — | — | EP | claimed |
| US-4340585-A | Salified anionic resin for cholesterol and lipid lowering | ALFA FARMACEUTICI, S.P.A. (IT) | 1982-07-20 | — | — | US | claimed |
| US-4301167-A | ANTIINFLAMMATORY AGENTS, ANALGESICS | INSTITUT MERIEUX (FR) | 1981-11-17 | — | — | US | claimed |
| US-4230622-A | Halogen derivatives of clavulaic acid | GLAXO LABORATORIES LIMITED (GB) | 1980-10-28 | — | — | US | claimed |
| US-4228074-A | Azetidinone derivatives | GLAXO LABORATORIES LIMITED (GB) | 1980-10-14 | — | — | US | claimed |
| US-4053608-A | 3-NITROPYRIDINE CARBOXAMIDES, POULTRY FEED | SANKYO COMPANY LIMITED (JA) | 1977-10-11 | — | — | US | claimed |