⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL396872 | 0.97 | — | — | |
| Water SCHEMBL396871 | 0.97 | TSHR (0.40) | — | |
| SCHEMBL13203689 | 0.78 | — | — | |
| SCHEMBL11024379 | 0.76 | — | — | |
| SCHEMBL1700958 | 0.74 | CHRNB2 (0.48) | — | |
| SCHEMBL1577795 | 0.74 | CHRNB2 (0.48) | — | |
| SCHEMBL1577796 | 0.74 | CHRNB2 (0.48) | — | |
| SCHEMBL21628983 | 0.73 | TSHR (0.32) | — | |
| SCHEMBL82111 | 0.71 | — | — | |
| SCHEMBL8589134 | 0.71 | — | — |
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 191 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114539273-A | Novel heterocyclic derivatives useful as SHP2 inhibitors | 北京加科思新药研发有限公司 | 2022-05-27 | — | — | CN | claimed |
| CN-109923108-B | Pyridyl-substituted indole compounds | 百时美施贵宝公司 | 2022-04-29 | — | — | CN | claimed |
| CN-114096246-A | Therapeutic compositions comprising deuterated or partially deuterated N, N-dimethyltryptamine compounds | 斯玛尔药物有限公司 | 2022-02-25 | — | — | CN | claimed |
| CN-105593224-B | Novel quinazolinones as bromodomain inhibitors | 恒元生物医药科技(苏州)有限公司 | 2021-05-25 | — | — | CN | claimed |
| CN-110776454-A | Synthesis method of bufotenine and quaternary ammonium salt thereof and application of bufotenine and quaternary ammonium salt thereof in preparation of analgesic and anti-inflammatory drugs | 马宏跃 | 2020-02-11 | — | — | CN | claimed |
| CN-108645933-A | The gas-chromatography detection method of residual solvent in Eliquis bulk pharmaceutical chemicals | 河北常山生化药业股份有限公司 | 2018-10-12 | — | — | CN | claimed |
| US-20180092924-A1 | NOVEL QUINAZOLINONES AS BROMODOMAIN INHIBITORS | RVX THERAPEUTICS INC. (CA) | 2018-04-05 | — | — | US | claimed |
| EP-3027604-A2 | NOVEL QUINAZOLINONES AS BROMODOMAIN INHIBITORS | Zenith Epigenetics Corp. (CA) | 2016-06-08 | — | — | EP | claimed |
| CN-105593224-A | Novel quinazolinones as bromodomain inhibitors | ZENITH EPIGENETICS CORP | 2016-05-18 | — | — | CN | claimed |
| CN-103664901-B | A kind of rizatriptan benzoate preparation method | SICHUAN UNIVERSITY (CN) | 2016-04-13 | — | — | CN | claimed |
| CN-1310906-C | Indole-type derivatives as inhibitors of p38 kinase | SCOIS INC (US) | 2007-04-18 | — | — | CN | claimed |
| CN-1930160-A | HIV integrase inhibitors | MERCK & CO INC (US) | 2007-03-14 | — | — | CN | claimed |
| CN-1929737-A | HIV integrase inhibitors | MERCK & CO INC (US) | 2007-03-14 | — | — | CN | claimed |
| EP-1717227-A1 | Substituted indole compounds, their preparation and use in medicaments | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2006-11-02 | — | — | EP | claimed |
| WO-2006015867-A1 | SUBSTITUTED INDOLE COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2006-02-16 | — | — | WO | claimed |
| EP-1173411-A1 | POLYALDIMINES OF OLIGOMERIC AMINOBENZOIC ACID DERIVATIVES, AND THEIR USE FOR PREPARATION OF MOISTURE-CURABLE, STORAGE-STABLE, ONE-PART POLYREAS | Finetech Ltd (IL) | 2002-01-23 | — | — | EP | claimed |
| WO-2000064860-A1 | POLYALDIMINES OF OLIGOMERIC AMINOBENZOIC ACID DERIVATIVES, AND THEIR USE FOR PREPARATION OF MOISTURE-CURABLE, STORAGE-STABLE, ONE-PART POLYREAS | FINETECH LTD. (IL) | 2000-11-02 | — | — | WO | claimed |
| EP-0682025-A1 | 5,6-dihydro-4H-imidazo 2',1':2,3 imidazo 4,5,1-ij quinoline and 4,5-dihydroimidazo 1,2-a pyrrolo 1,2,3-cd benzimidazol derivatives | SYNTHELABO (FR) | 1995-11-15 | — | — | EP | claimed |
| EP-0607076-A1 | 9H-Imidazo 1,2-a benzimidazole derivatives with GABA activity | SYNTHELABO (FR) | 1994-07-20 | — | — | EP | claimed |
| EP-0605295-A1 | Derivatives of 2-thienylimidazo 2,1-b benzothiazole-3-acetic acid, their preparation and their therapeutical use | SYNTHELABO (FR) | 1994-07-06 | — | — | EP | claimed |