⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11670125 | 0.71 | — | — | |
| SCHEMBL166729 | 0.71 | — | — | |
| Water SCHEMBL28268658 | 0.69 | — | — | |
| SCHEMBL8724480 | 0.66 | — | — | |
| SCHEMBL575061 | 0.62 | — | — | |
| SCHEMBL22750854 | 0.62 | — | — | |
| SCHEMBL575062 | 0.62 | — | — | |
| SCHEMBL7733750 | 0.59 | — | — | |
| SCHEMBL22750843 | 0.59 | — | — | |
| SCHEMBL371007 | 0.59 | — | — |
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 88 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977419-A | Process for the preparation of substituted phenylpropenes | BAYER AKTIENGESELLSCHAFT (DE) | 1999-11-02 | — | — | US | claimed |
| EP-0436989-B1 | Process for rearranging allylic geminal dihalogen compounds | DOWELANCO (US) | 1995-03-22 | — | — | EP | claimed |
| US-5072063-A | Catalytic isomerization of 3,3-dihalopropene; continuous processing of by-product stream components; high yield and selectivity; chemical intermediates | DOWELANCO (US) | 1991-12-10 | — | — | US | claimed |
| EP-0436989-A1 | Process for rearranging allylic geminal dihalogen compounds | DOWELANCO (US) | 1991-07-17 | — | — | EP | claimed |
| US-3951614-A | REACTION PRODUCT OF A HYDROCARBYL AMINE AND POLYFUNCTIONAL COUPLING AGENT | CHEVRON RESEARCH COMPANY (US) | 1976-04-20 | — | — | US | claimed |
| JP-1254634-A | — | — | None | — | — | JP | disclosed |
| JP-6340561-A | — | — | None | — | — | JP | disclosed |
| CN-119019218-A | Method for preparing 1,2, 3-tetrachloropropene by mixing 1, 3-dichloropropene and 3-chloropropene | 江苏扬农化工集团有限公司 | 2024-11-26 | — | — | CN | disclosed |
| WO-2023074370-A1 | AQUEOUS AGROCHEMICAL SUSPENSION COMPOSITION, METHOD FOR PREVENTING CROP DAMAGE, AND SEED OF USEFUL PLANT | クミアイ化学工業株式会社 | 2023-05-04 | — | — | WO | disclosed |
| WO-2023074372-A1 | AQUEOUS AGROCHEMICAL SUSPENSION COMPOSITION, PLANT DISEASE CONTROL METHOD, AND SEED OF USEFUL PLANT | クミアイ化学工業株式会社 | 2023-05-04 | — | — | WO | disclosed |
| CN-114436990-A | Trifluoromethyl oxadiazole compound, preparation method and application thereof, and bactericide | 江苏中旗科技股份有限公司 | 2022-05-06 | — | — | CN | disclosed |
| US-10696686-B2 | Herbicidally active (alkynyl-phenyl)-substituted cyclic dione compounds and derivatives thereof | SYNGENTA LIMITED (GB) | 2020-06-30 | — | — | US | disclosed |
| JP-H06340561-A | REARRANGEMENT OF ALLYLIC GEMINAL DIHALOGEN COMPOUND | DOWELANCO | 1994-12-13 | — | — | JP | disclosed |
| US-5072063-A | Catalytic isomerization of 3,3-dihalopropene; continuous processing of by-product stream components; high yield and selectivity; chemical intermediates | DOWELANCO (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0436989-A1 | Process for rearranging allylic geminal dihalogen compounds | DOWELANCO (US) | 1991-07-17 | — | — | EP | disclosed |
| JP-H01254634-A | PRODUCTION OF CYCLOALKANOL AND/OR ESTER THEREOF | MITSUI PETROCHEM IND LTD | 1989-10-11 | — | — | JP | disclosed |
| US-4609673-A | ANTILIPEMIC AGENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1986-09-02 | — | — | US | disclosed |
| US-4382934-A | ANTIALLERGENS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1983-05-10 | — | — | US | disclosed |
| US-4309471-A | REDUCTION IN MODULATION NOISE | FUJI PHOTO FILM CO., LTD. (JP) | 1982-01-05 | — | — | US | disclosed |
| US-3951614-A | REACTION PRODUCT OF A HYDROCARBYL AMINE AND POLYFUNCTIONAL COUPLING AGENT | CHEVRON RESEARCH COMPANY (US) | 1976-04-20 | — | — | US | disclosed |