⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1500025 | 0.96 | — | — | |
| SCHEMBL8749411 | 0.86 | — | — | |
| SCHEMBL8749656 | 0.86 | — | — | |
| SCHEMBL8749412 | 0.86 | — | — | |
| SCHEMBL3167012 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL8749706 | 0.83 | IDO1 (0.33) | — | |
| SCHEMBL7898641 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL4662075 | 0.83 | IDO1 (0.33) | — | |
| SCHEMBL3963209 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL4662080 | 0.83 | IDO1 (0.33) | — |
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 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110128303-B | Method for synthesizing musk extract (2R,5R) -Musclide-A1 | 中国农业大学 | 2020-12-18 | — | — | CN | claimed |
| CN-110294972-A | A kind of ink | 深圳TCL工业研究院有限公司 | 2019-10-01 | — | — | CN | claimed |
| CN-110256246-A | A kind of method of asymmetry catalysis synthesis of chiral acetylenic glycols ester | 中国农业大学 | 2019-09-20 | — | — | CN | claimed |
| CN-110128303-A | A kind of method of musk ambrette extract (2R, 5R)-Musclide-A1 | 中国农业大学 | 2019-08-16 | — | — | CN | claimed |
| EP-2697193-B1 | SUBSTITUTED 5-(CYCLOHEX-2-EN-1-YL)-PENTA-2,4-DIENES AND 5-(CYCLOHEX-2-EN-1-YL)-PENT-2-EN-4-INES AS ACTIVE AGENTS AGAINST ABIOTIC STRESS IN PLANTS | BAYER IP GMBH (DE) | 2016-07-06 | — | — | EP | claimed |
| CN-102093166-B | Method for synthesizing marine natural product by using high optical activity enantiomer | UNIV CHINA AGRICULTURAL | 2014-04-09 | — | — | CN | claimed |
| CN-102093406-B | Chiral cyclopropane alkamine ligand compound, and preparation and application thereof | UNIV CHINA AGRICULTURAL | 2013-07-24 | — | — | CN | claimed |
| CN-102093406-A | Chiral cyclopropane alkamine ligand compound, and preparation and application thereof | UNIV CHINA AGRICULTURAL | 2011-06-15 | — | — | CN | claimed |
| CN-102093166-A | Method for synthesizing marine natural product by using high optical activity enantiomer | UNIV CHINA AGRICULTURAL | 2011-06-15 | — | — | CN | claimed |
| CN-1378424-A | Selective herbicides on basis of n-aryl-trizoline (thio) ones | BAYER AG (DE) | 2002-11-06 | — | — | CN | claimed |
| WO-2023004102-A2 | COMPOSITIONS AND METHODS FOR INHIBITION OF RAS | THERAS, INC. (US) | 2023-01-26 | — | — | WO | disclosed |
| CN-110128303-B | Method for synthesizing musk extract (2R,5R) -Musclide-A1 | 中国农业大学 | 2020-12-18 | — | — | CN | disclosed |
| CN-110128303-B | Method for synthesizing musk extract (2R,5R) -Musclide-A1 | 中国农业大学 | 2020-12-18 | — | — | CN | disclosed |
| CN-110294972-A | A kind of ink | 深圳TCL工业研究院有限公司 | 2019-10-01 | — | — | CN | disclosed |
| CN-110256246-A | A kind of method of asymmetry catalysis synthesis of chiral acetylenic glycols ester | 中国农业大学 | 2019-09-20 | — | — | CN | disclosed |
| US-4288436-A | ANTIBIOTICS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1981-09-08 | — | — | US | disclosed |
| US-4045485-A | ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC AND ANTIPRURITIC ACTIVITY | SYNTEX CORPORATION (US) | 1977-08-30 | — | — | US | disclosed |
| US-3960936-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, SKIN DISORDERS | SYNTEX CORPORATION (PM) | 1976-06-01 | — | — | US | disclosed |
| US-3947472-A | ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC | SYNTEX CORPORATION (PM) | 1976-03-30 | — | — | US | disclosed |
| US-3935273-A | ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC | SYNTEX CORPORATION (US) | 1976-01-27 | — | — | US | disclosed |