⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3351890 | 1.00 | — | — | |
| Benzene SCHEMBL27537719 | 0.91 | ALDH1A1 (0.40) | — | |
| Chloroform SCHEMBL27635521 | 0.88 | MEN1 (0.32) | — | |
| Aziridine SCHEMBL27342399 | 0.86 | PNMT (0.35) | — | |
| Diallylsulfone SCHEMBL9947 | 0.74 | — | — | |
| SCHEMBL2016950 | 0.74 | CA2 (0.32) | — | |
| Diallylsulfone SCHEMBL17707262 | 0.71 | CA2 (0.31) | — | |
| SCHEMBL982269 | 0.71 | — | — | |
| Diallylsulfone SCHEMBL9518459 | 0.71 | CA2 (0.31) | — | |
| SCHEMBL2813730 | 0.69 | — | — |
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 25742 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-115232117-B | Substituted isoxazole pyrimidine amine compound, preparation method and application thereof | 沈阳中化农药化工研发有限公司 | 2024-07-16 | — | — | CN | claimed |
| WO-2024147917-A1 | DIELECTRIC FILM FORMING COMPOSITION CONTAINING ACYL GERMANIUM COMPOUND | FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) | 2024-07-11 | — | — | WO | claimed |
| WO-2024140700-A1 | BENZOTHIAZOLE COMPOUND, AND SYNTHESIS THEREFOR AND USE THEREOF | 西北农林科技大学 | 2024-07-04 | — | — | WO | claimed |
| US-20240215577-A1 | FUNGICIDAL PYRIDONES | FMC CORPORATION | 2024-07-04 | — | — | US | claimed |
| WO-2024132865-A1 | ANTIMICROBIAL COMPOUND, PROCESS FOR PREPARING SAME AND USE OF THE ANTIMICROBIAL COMPOUND FOR PREPARING A COSMETIC OR PHARMACEUTICAL COMPOSITION | AEROCHEMICA DR. DEPPE GMBH (DE) | 2024-06-27 | — | — | WO | claimed |
| US-20240208927-A1 | WNT SIGNALING PATHWAY INHIBITORS FOR TREATMENTS OF DISEASE | UNIVERSITY OF MARYLAND, BALTIMORE | 2024-06-27 | — | — | US | claimed |
| EP-4389219-A1 | ANTIMICROBIAL COMPOUND, METHOD FOR ITS PREPARATION AND USE OF THE ANTIMICROBIAL COMPOUND FOR THE PREPARATION OF A COSMETIC OR PHARMACEUTICAL COMPOSITION | Aerochemica Dr. Deppe GmbH (DE) | 2024-06-26 | — | — | EP | claimed |
| EP-3957627-B1 | 6-MEMBERED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | SHIONOGI & CO (JP) | 2024-06-19 | — | — | EP | claimed |
| WO-2024117205-A1 | BICYCLIC PYRIDINE DERIVATIVE AND SALT THEREOF, AND HARMFUL ORGANISM CONTROL AGENT CHARACTERIZED BY CONTAINING SAID DERIVATIVE OR SALT THEREOF AS ACTIVE INGREDIENT | 北興化学工業株式会社 | 2024-06-06 | — | — | WO | claimed |
| WO-2024112123-A1 | NOVEL COMPOUND AS SELECTIVE ESTROGEN RECEPTOR MODULATOR | 재단법인 대구경북첨단의료산업진흥재단 | 2024-05-30 | — | — | WO | claimed |
| US-4043991-A | Preparation of peptides and cephalosporins | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1977-08-23 | — | — | US | claimed |
| US-4040836-A | MAGENTA | FUJI PHOTO FILM CO., LTD. (JA) | 1977-08-09 | — | — | US | claimed |
| US-4035385-A | NEUROLEPTIC AGENTS, PROPYNYLAMINE-SUBSTITUTED | HOFFMANN-LA ROCHE INC. (US) | 1977-07-12 | — | — | US | claimed |
| US-4032346-A | 5-OXO-2-PYRAZOLIN-4-YL-AMINE-CARBODITHIOATE-DITHIOCARBONATE | FUJI PHOTO FILM CO., LTD. (JA) | 1977-06-28 | — | — | US | claimed |
| US-4005083-A | FUNGICIDES, BACTERICIDES AND PLANT GROWTH REGULATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-01-25 | — | — | US | claimed |
| US-3989691-A | FROM A QUINOLINE | PRINCETON UNIVERSITY (US) | 1976-11-02 | — | — | US | claimed |
| US-3984247-A | Dye-containing silver halide photographic light-sensitive material | FUJI PHOTO FILM CO., LTD. (JA) | 1976-10-05 | — | — | US | claimed |
| US-3966743-A | ANTIMICROBIAL | BOEHRINGER MANNHEIM G.M.B.H. (DT) | 1976-06-29 | — | — | US | claimed |
| US-3943120-A | WATER INSOLUBLE | CIBA-GEIGY AG (CH) | 1976-03-09 | — | — | US | claimed |
| US-3936429-A | Reactive polymer | FUJI PHOTO FILM CO., LTD. (JA) | 1976-02-03 | — | — | US | claimed |