⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27515807 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL27658872 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL27606327 | 0.97 | — | — | |
| SCHEMBL29242004 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL27311178 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL27267233 | 0.94 | ALDH1A1 (0.53) | — | |
| SCHEMBL28604360 | 0.89 | ALDH1A1 (0.48) | — | |
| SCHEMBL29010130 | 0.89 | ALDH1A1 (0.48) | — | |
| SCHEMBL27294507 | 0.89 | ALDH1A1 (0.48) | — | |
| Magnesium Chloride Anhydrous SCHEMBL27404967 | 0.89 | ALDH1A1 (0.48) | — |
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 18024 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 |
|---|---|---|---|---|---|---|---|
| EP-4399198-A2 | DUAL INHIBITOR OF HISTONE DEACETYLASE 6 AND HEAT SHOCK PROTEIN 90 | Taipei Medical University (TW) | 2024-07-17 | — | — | EP | claimed |
| CN-118324804-A | Aromatic phosphonate compound and synthesis method thereof | 海南大学 | 2024-07-12 | — | — | CN | claimed |
| CN-118324729-A | Synthesis method of 3-alkenyl benzofuran compound | 青岛科技大学 | 2024-07-12 | — | — | CN | claimed |
| CN-118302401-A | Dual inhibitors of histone deacetylase 6 and heat shock protein 90 | 台北医学大学 | 2024-07-05 | — | — | CN | claimed |
| US-20240217913-A2 | PREPARATION OF SUBSTITUTED ACRYLATE COMPOUND | HUA MEDICINE (SHANGHAI) LTD. (CN) | 2024-07-04 | — | — | US | claimed |
| CN-115925728-B | Preparation method and application of near infrared probe for kidney injury diagnosis | 南京林业大学 | 2024-06-28 | — | — | CN | claimed |
| EP-3845535-B1 | HYDRAZINOPURINE COMPOUND AND TRIAZOLOPURINE COMPOUND FOR INHIBITING XANTHINE OXIDASE | TERA STONE CO LTD (JP) | 2024-06-26 | — | — | EP | claimed |
| EP-4384226-A2 | DIPHOSPHINE COMPOUNDS AND COMPLEXES | Cancer Research Technology Limited (GB) | 2024-06-19 | — | — | EP | claimed |
| CN-118184663-A | Nitrogen-containing heterocyclic compound, and preparation method and application thereof | 湖北宜美特全息科技有限公司 | 2024-06-14 | — | — | CN | claimed |
| CN-118184587-A | Cyano-substituted benzimidazole luminescent compound and preparation method thereof | 中国科学院化学研究所 | 2024-06-14 | — | — | CN | claimed |
| US-4145215-A | PHOTOCONDUCTIVE PIGMENTS | EASTMAN KODAK COMPANY (US) | 1979-03-20 | — | — | US | claimed |
| US-4136033-A | DIAZO COUPLERS | SANDOZ LTD. (CH) | 1979-01-23 | — | — | US | claimed |
| US-4101540-A | USEFUL FOR DYEING ACRYLONITRILE POLYMERS OR ACID-MODIFIED POLYESTERS OR POLYAMIDES | PRODUITS CHIMIQUES UGINE KUHLMANN (FR) | 1978-07-18 | — | — | US | claimed |
| US-4057539-A | DYES, COLORFASTNESS | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) | 1977-11-08 | — | — | US | claimed |
| US-4031112-A | Cyclic acetals | BASF AKTIENGESELLSCHAFT (DT) | 1977-06-21 | — | — | US | claimed |
| US-4026891-A | HYPOTENSIVE AGENTS, ANTITHROMBOTICS, AND CARDIOTONICS | BOEHRINGER INGELHEIM GMBH (DT) | 1977-05-31 | — | — | US | claimed |
| US-4025555-A | Aromatic amidines as antiviral agents in animals | PFIZER INC. (US) | 1977-05-24 | — | — | US | claimed |
| US-3978055-A | SEDATIVE, ANTIINFLAMMATORY, VASODILATION, BRONCHODILATION | DELALANDE S.A. (FR) | 1976-08-31 | — | — | US | claimed |
| US-3974147-A | DIHYDRO-HETEROCYCLIC AMINES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1976-08-10 | — | — | US | claimed |
| US-3956307-A | FUNGICIDES | SCHERING AKTIENGESELLSCHAFT (DT) | 1976-05-11 | — | — | US | claimed |