⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31088351 | 0.83 | MALT1 (0.34) | — | |
| SCHEMBL20909482 | 0.82 | ALDH1A1 (0.55) | — | |
| SCHEMBL27622608 | 0.80 | NPSR1 (0.39) | — | |
| SCHEMBL1239684 | 0.73 | — | — | |
| SCHEMBL5902597 | 0.72 | — | — | |
| SCHEMBL30171078 | 0.72 | CHRM3 (0.36) | — | |
| Benzene SCHEMBL7938846 | 0.71 | NPC1 (0.33) | — | |
| SCHEMBL9055451 | 0.71 | NPC1 (0.41) | — | |
| SCHEMBL27684134 | 0.70 | ALDH1A1 (0.39) | — | |
| Benzene SCHEMBL5373706 | 0.68 | NPC1 (0.42) | — |
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 140 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108212120-A | A kind of preparation method of safe ten thousand rhzomorphs upgrading material | 孝感市锐思新材科技有限公司 | 2018-06-29 | — | — | CN | claimed |
| CN-108192028-A | A kind of preparation method of dodecanedioic acid purification material | 孝感市锐思新材科技有限公司 | 2018-06-22 | — | — | CN | claimed |
| CN-107987130-A | A kind of preparation method of colistin sulfate purification adsorbent | 孝感市锐思新材科技有限公司 | 2018-05-04 | — | — | CN | claimed |
| CN-100486973-C | Novel benzodioxoles | HOFFMANN LA ROCHE (CH) | 2009-05-13 | — | — | CN | claimed |
| CN-116194108-B | Novel dioxoisoquinolinone derivatives and use thereof | 韩美药品株式会社 | 2025-05-30 | — | — | CN | disclosed |
| CN-119954787-A | Modulators of methyl-modified enzymes, compositions and uses thereof | 星座制药公司 | 2025-05-09 | — | — | CN | disclosed |
| CN-111989325-B | Modulators of methyl-modified enzymes, compositions and uses thereof | 星座制药公司 | 2025-02-25 | — | — | CN | disclosed |
| CN-119301129-A | Tricyclic compounds and uses thereof | 和记黄埔医药（上海）有限公司 | 2025-01-10 | — | — | CN | disclosed |
| CN-118450907-A | Antibody drug conjugates | 百济神州有限公司 | 2024-08-06 | — | — | CN | disclosed |
| CN-114423426-B | EZH2 inhibition combination therapy for the treatment of cancer | 星座制药公司 | 2024-04-05 | — | — | CN | disclosed |
| US-20240092766-A1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMA (US) | 2024-03-21 | — | — | US | disclosed |
| CN-117597341-A | Sulfonamide derivative, preparation method and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2024-02-23 | — | — | CN | disclosed |
| CN-1938279-A | Modulators of atp-binding cassette transporters | VERTEX PHARMA (US) | 2007-03-28 | — | — | CN | disclosed |
| EP-1716122-A1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2006-11-02 | — | — | EP | disclosed |
| CN-1659144-A | Quinoline and isoquinoline derivatives, process for their preparation and their use as inflammation inhibitors | SCHERING AG (DE) | 2005-08-24 | — | — | CN | disclosed |
| WO-2005075435-A1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-08-18 | — | — | WO | disclosed |
| EP-0811001-B1 | BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS | WARNER LAMBERT CO (US) | 2001-10-31 | — | — | EP | disclosed |
| CN-1200179-A | A method of determining oxygen concentration in a sample | NYCOMED IMAGING AS (NO) | 1998-11-25 | — | — | CN | disclosed |
| CN-1193952-A | Heterocyclic methyl radicals as imaging enhancers | NYCOMED IMAGING AS (NO) | 1998-09-23 | — | — | CN | disclosed |
| EP-0811001-A1 | BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1997-12-10 | — | — | EP | disclosed |