⚠ 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 | |
|---|---|---|---|---|
| Phenol SCHEMBL27440604 | 0.89 | MAPT (0.55) | — | |
| SCHEMBL6994743 | 0.82 | MAPT (0.69) | — | |
| SCHEMBL6994738 | 0.82 | MAPT (0.69) | — | |
| SCHEMBL11334153 | 0.81 | NPC1 (0.47) | — | |
| SCHEMBL3165195 | 0.80 | — | — | |
| SCHEMBL7827549 | 0.78 | — | — | |
| SCHEMBL21843896 | 0.78 | — | — | |
| Water SCHEMBL10939261 | 0.78 | CES2 (0.58) | — | |
| SCHEMBL6199324 | 0.78 | — | — | |
| SCHEMBL3246325 | 0.77 | MAPT (0.62) | — |
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 109 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115650837-B | Method for preparing ketone compound by 1,4 addition reaction of alpha, beta unsaturated ketene | 南京工业大学 | 2024-05-17 | — | — | CN | claimed |
| CN-115650837-A | Method for preparing ketone compound by utilizing 1,4 addition reaction of alpha, beta unsaturated ketene | 南京工业大学 | 2023-01-31 | — | — | CN | claimed |
| CN-109837079-A | A kind of high injection salt resistance polymers for oil recovery, three-component compound system and preparation method thereof | 大庆再创科技有限公司 | 2019-06-04 | — | — | CN | claimed |
| US-9296656-B2 | UV protective coatings | INTERNATIONAL TECHNOLOGY CENTER (US) | 2016-03-29 | — | — | US | claimed |
| WO-2012107488-A2 | METAL-FREE PHOTOSENSITIZERS | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2012-08-16 | — | — | WO | claimed |
| US-20090297828-A1 | Uv protective coatings | INTERNATIONAL TECHNOLOGY CENTER (US) | 2009-12-03 | — | — | US | claimed |
| US-7612138-B2 | coating material comprising an onion-like-carbon nanoparticles suspended in a binder; absorbing radiation in the frequency range of approximately 500MHz to 30 THz; use in electromagnetic Interference shielding structure | INTERNATIONAL TECHNOLOGY CENTER (US) | 2009-11-03 | — | — | US | claimed |
| US-20060241236-A1 | Electromagnetic radiation attenuation | KUZNETSOV VLADIMIR L | 2006-10-26 | — | — | US | claimed |
| US-12365927-B2 | Engineered ketoreductase polypeptides | CODEXIS, INC. (US) | 2025-07-22 | — | — | US | disclosed |
| CN-115650837-B | Method for preparing ketone compound by 1,4 addition reaction of alpha, beta unsaturated ketene | 南京工业大学 | 2024-05-17 | — | — | CN | disclosed |
| CN-117945820-A | Method for synthesizing alpha, beta-unsaturated aldehyde compound by copper catalysis | 江苏海洋大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-116745281-A | Curing catalyst, resin composition, sealing material, adhesive, and cured product | 纳美仕有限公司 | 2023-09-12 | — | — | CN | disclosed |
| US-20230104779-A1 | ENGINEERED KETOREDUCTASE POLYPEPTIDES | INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT | 2023-04-06 | — | — | US | disclosed |
| CN-115650837-A | Method for preparing ketone compound by utilizing 1,4 addition reaction of alpha, beta unsaturated ketene | 南京工业大学 | 2023-01-31 | — | — | CN | disclosed |
| US-20060241236-A1 | Electromagnetic radiation attenuation | KUZNETSOV VLADIMIR L | 2006-10-26 | — | — | US | disclosed |
| EP-1670779-A2 | METHODS FOR THE PRODUCTION OF 3-METHYLAMINO-1-(THIENE-2-YL)-PROPANE-1-OL | BASF Aktiengesellschaft (DE) | 2006-06-21 | — | — | EP | disclosed |
| WO-2005033094-A2 | METHODS FOR THE PRODUCTION OF 3-METHYLAMINO-1-(THIENE-2-YL)-PROPANE-1-OL | BASF AKTIENGESELLSCHAFT (DE) | 2005-04-14 | — | — | WO | disclosed |
| EP-0630891-A1 | 3-Isothiazolones derivatives and their use as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1994-12-28 | — | — | EP | disclosed |
| US-5321141-A | Reacting an isothiazole with an a,b-unsaturated ketone or aldehyde | ROHM AND HAAS COMPANY (US) | 1994-06-14 | — | — | US | disclosed |
| US-5288693-A | Microbiocides | ROHM AND HAAS COMPANY (US) | 1994-02-22 | — | — | US | disclosed |