⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL815298 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL816679 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL816616 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL814955 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL4817022 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL816680 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL817000 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL817001 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL815297 | 1.00 | TRPA1 (0.43) | — | |
| SCHEMBL817683 | 1.00 | TRPA1 (0.43) | — |
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 175 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117342949-A | Biaryl acid, linear polyaramide and cross-linked polyaramide and preparation method | 江汉大学 | 2024-01-05 | — | — | CN | claimed |
| CN-116157397-A | Heterocyclylpyridines as novel fungicides | 拜耳公司 | 2023-05-23 | — | — | CN | claimed |
| CN-115955916-A | Active compound combinations | 拜耳公司 | 2023-04-11 | — | — | CN | claimed |
| CN-115803320-A | Heterocyclyl pyrimidines and triazines as novel fungicides | 拜耳公司 | 2023-03-14 | — | — | CN | claimed |
| US-20050171078-A1 | Novel azacyclic ethynyl derivatives | NEUROSEARCH (DK) | 2005-08-04 | — | — | US | claimed |
| EP-1506205-A2 | NOVEL AZACYCLIC ETHYNYL DERIVATIVES | NEUROSEARCH A/S (DK) | 2005-02-16 | — | — | EP | claimed |
| WO-2003094830-A2 | NOVEL AZACYCLIC ETHYNYL DERIVATIVES | NEUROSEARCH A/S (DK) | 2003-11-20 | — | — | WO | claimed |
| CN-118317956-A | Bis (hetero) aryl thioether oxadiazines as fungicidal compounds | 拜耳公司 | 2024-07-09 | — | — | CN | disclosed |
| WO-2024137780-A1 | PANK MODULATORS AND METHODS OF TREATMENT USING SAME | YALE UNIVERSITY (US) | 2024-06-27 | — | — | WO | disclosed |
| CN-117903036-A | Synthesis and application of novel FXR (FXR) agonist | 厦门市博瑞来医药科技有限公司 | 2024-04-19 | — | — | CN | disclosed |
| CN-117730082-A | Synthesis of substituted tricyclic amides and analogs thereof | 爱彼特生物制药公司 | 2024-03-19 | — | — | CN | disclosed |
| CN-117645642-A | Compounds for RNA capping and uses thereof | 广州市恒诺康医药科技有限公司 | 2024-03-05 | — | — | CN | disclosed |
| WO-2024038356-A1 | SYNTHESIS OF SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS AND SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND ANALOGUES THEREOF | ARBUTUS BIOPHARMA CORPORATION (CA) | 2024-02-22 | — | — | WO | disclosed |
| WO-2002002564-A1 | ARYL AND HETEROARYL DIAZABICYCLOALKANES, THEIR PREPARATION AND USE | NEUROSEARCH A/S (DK) | 2002-01-10 | — | — | WO | disclosed |
| US-6215016-B1 | HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA | TORAY INDUSTRIES, INC. (JP) | 2001-04-10 | — | — | US | disclosed |
| US-6100292-A | Ketone derivatives and their medical applications | TORAY INDUSTRIES, INC. (JP) | 2000-08-08 | — | — | US | disclosed |
| EP-0980867-A1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 2000-02-23 | — | — | EP | disclosed |
| EP-0841063-A1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 1998-05-13 | — | — | EP | disclosed |
| US-4581225-A | CARDIOTONIC AGENTS; A CATECHOLAMINE, DOBUTAMINE | ELI LILLY AND COMPANY (US) | 1986-04-08 | — | — | US | disclosed |
| EP-0160501-A2 | Sustained release intranasal formulation and method of use thereof | ELI LILLY AND COMPANY (US) | 1985-11-06 | — | — | EP | disclosed |