⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL815779 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL63178 | 0.97 | — | — | |
| SCHEMBL814708 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL816118 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL815452 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL37876 | 0.97 | — | — | |
| SCHEMBL816879 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL816961 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL167832 | 0.97 | ALDH1A1 (0.44) | — | |
| SCHEMBL814801 | 0.97 | ALDH1A1 (0.44) | — |
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 6195 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-3750894-B1 | UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF | BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) | 2024-04-03 | — | — | EP | claimed |
| WO-2024022481-A1 | PHENYL-SUBSTITUTED DIHYDRONAPHTHYRIDINE COMPOUNDS, AND PREPARATION AND USE THEREOF | 苏中药业集团股份有限公司 | 2024-02-01 | — | — | WO | claimed |
| CN-117402078-A | Method for efficiently preparing allyl acylhydrazone in one step | 中国科学院山西煤炭化学研究所 | 2024-01-16 | — | — | CN | claimed |
| US-20240002736-A1 | RANDOM ACRYLIC TERPOLYMERS OF CONTROLLED MOLECULAR MASS USEFUL AS WATER IN CRUDE OIL EMULSIONS DESTABILIZERS | INSTITUTO MEXICANO DEL PETRÓLEO (MX) | 2024-01-04 | — | — | US | claimed |
| EP-3590941-B1 | UREA-SUBSTITUTED AROMATIC RING-LINKED DIOXANE-QUINAZOLINE AND -LINKED DIOXANE-QUINOLINE COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF | BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) | 2023-11-22 | — | — | EP | claimed |
| CN-116496256-A | Carbonyl bridged heterocyclic compound, and composition and application thereof | 北京赛特明强医药科技有限公司 | 2023-07-28 | — | — | CN | claimed |
| WO-2023131116-A1 | CARBONYL BRIDGED HETEROCYCLIC COMPOUND, AND COMPOSITION AND APPLICATION THEREOF | 北京赛特明强医药科技有限公司 | 2023-07-13 | — | — | WO | claimed |
| CN-110191885-B | Alkoxy bis-heteroaryl derivatives as modulators of protein aggregation | UCB生物制药私人有限公司 | 2023-05-16 | — | — | CN | claimed |
| EP-3750893-B1 | DIOXAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF | BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) | 2023-04-19 | — | — | EP | claimed |
| CN-115677529-A | Method for efficiently preparing acylhydrazone in one step | 中国科学院山西煤炭化学研究所 | 2023-02-03 | — | — | CN | claimed |
| US-4894181-A | Carbocyclic compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1990-01-16 | — | — | US | claimed |
| US-4882082-A | PYRIMIDINE DERIVATIVE LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-11-21 | — | — | US | claimed |
| US-4846998-A | LIQUID CRYSTALS, ESTERS, NITRILES; ETHERS, HYDROCARBONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-07-11 | — | — | US | claimed |
| US-4820839-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1989-04-11 | — | — | US | claimed |
| US-4758373-A | Carbocyclic compounds | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-07-19 | — | — | US | claimed |
| EP-0132553-B1 | BICYCLOHEXYLES | MERCK PATENT GmbH (DE) | 1988-02-10 | — | — | EP | claimed |
| EP-0135062-B1 | CYCLOHEXYLDIOXANES | MERCK PATENT GmbH (DE) | 1987-11-25 | — | — | EP | claimed |
| US-4496745-A | Epoxycarbacyclin derivatives, their preparation and use | SANKYO COMPANY, LIMITED (JP) | 1985-01-29 | — | — | US | claimed |
| US-4360375-A | Phenoxyphenoxy unsaturated derivatives and herbicidal composition | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1982-11-23 | — | — | US | claimed |
| US-4060631-A | Aminoethyl oxime ethers having anti-depressive activity | U.S. PHILIPS CORPORATION (US) | 1977-11-29 | — | — | US | claimed |