⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6829225 | 0.85 | ALDH1A1 (0.40) | — | |
| SCHEMBL290547 | 0.74 | ALDH1A1 (0.43) | — | |
| SCHEMBL5539585 | 0.73 | NPC1 (0.39) | — | |
| SCHEMBL512152 | 0.73 | CYP1A2 (0.46) | — | |
| SCHEMBL21295764 | 0.73 | NOTUM (0.46) | — | |
| SCHEMBL16401811 | 0.73 | ALDH1A1 (0.46) | — | |
| SCHEMBL3785401 | 0.73 | TAAR1 (0.46) | — | |
| SCHEMBL5539417 | 0.73 | PTGS1 (0.38) | — | |
| SCHEMBL21295725 | 0.69 | ALDH1A1 (0.52) | — | |
| SCHEMBL5534498 | 0.69 | KIF11 (0.52) | — |
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 5036 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 |
|---|---|---|---|---|---|---|---|
| US-RE49118-E1 | Material for organic electroluminescence device and electroluminescence device employing the same | IDEMITSU KOSAN CO., LTD. (JP) | 2022-06-28 | — | — | US | claimed |
| CN-112390811-B | Dithia-anthrone derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2022-03-04 | — | — | CN | claimed |
| CN-114057711-A | Anthracene ketone spiro derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2022-02-18 | — | — | CN | claimed |
| CN-107556298-B | Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element | 出光兴产株式会社 | 2021-12-21 | — | — | CN | claimed |
| CN-107586290-B | Aromatic heterocyclic derivative, material for organic electroluminescent element, and organic electroluminescent element | 出光兴产株式会社 | 2021-05-11 | — | — | CN | claimed |
| EP-3201208-B1 | BORONIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2021-03-24 | — | — | EP | claimed |
| EP-3201207-B1 | BORONIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2021-02-24 | — | — | EP | claimed |
| CN-112390811-A | Dithia-anthrone derivative and preparation method and application thereof | 中国科学院理化技术研究所 | 2021-02-23 | — | — | CN | claimed |
| CN-107001391-B | Boronic acid derivatives | 默克专利股份公司 | 2020-11-27 | — | — | CN | claimed |
| US-10669289-B2 | Boronic acid derivatives | MERCK PATENT GMBH (DE) | 2020-06-02 | — | — | US | claimed |
| EP-0479892-A1 | FUSED-RING ARYL SUBSTITUTED IMIDAZOLES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-04-15 | — | — | EP | claimed |
| WO-1991015206-A1 | TREATMENT OF GLAUCOMA AND OCULAR HYPERTENSION WITH IMIDAZOLE ANGIOTENSIN-II RECEPTOR ANTAGONISTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-10-17 | — | — | WO | claimed |
| WO-1991014367-A1 | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS WITH IMIDAZOLE ANGIOTENSIN-II RECEPTOR ANTAGONISTS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-10-03 | — | — | WO | claimed |
| US-5034531-A | Viricides | SCHERING CORPORATION (US) | 1991-07-23 | — | — | US | claimed |
| WO-1991000281-A2 | FUSED-RING ARYL SUBSTITUTED IMIDAZOLES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-01-10 | — | — | WO | claimed |
| EP-0091213-B1 | PESTICIDAL DRY-FORM SEED TREATER COMPOSITIONS | FMC Corporation (US) | 1988-09-28 | — | — | EP | claimed |
| US-4751222-A | 2,3,4,5-tetrahydro-1H-3-benzazepines and CNS affecting use thereof | NOVO INDUSTRI A/S (DK) | 1988-06-14 | — | — | US | claimed |
| EP-0267740-A1 | Naphthyridine and pyridopyrazine compounds and pharmaceutical usage thereof | SCHERING CORPORATION (US) | 1988-05-18 | — | — | EP | claimed |
| US-4650797-A | HYPOTENSIVES | E. R. SQUIBB & SONS, INC. (US) | 1987-03-17 | — | — | US | claimed |
| EP-0204317-A2 | 2-Thio or oxo-4-aryl or heterocyclo-1,5(2H)-pyrimidinedicarboxylic acid diesters and 3-acyl-5-pyrimidinecarboxylic acids and esters | E.R. Squibb & Sons, Inc. (US) | 1986-12-10 | — | — | EP | claimed |