⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL7855880 | 0.95 | — | — | |
| SCHEMBL285 | 0.94 | — | — | |
| SCHEMBL5084531 | 0.94 | — | — | |
| Fluoride SCHEMBL9698194 | 0.94 | — | — | |
| SCHEMBL145743 | 0.94 | — | — | |
| SCHEMBL18185998 | 0.94 | ALDH1A1 (0.46) | — | |
| Hydrochloric Acid SCHEMBL23466884 | 0.89 | ALDH1A1 (0.42) | — | |
| SCHEMBL1080333 | 0.89 | — | — | |
| SCHEMBL5820312 | 0.89 | ALDH1A1 (0.42) | — | |
| SCHEMBL11125555 | 0.89 | ALDH1A1 (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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110809577-A | Modulators of adenosine A2A receptor | 雷沃医疗有限公司 | 2020-02-18 | — | — | CN | disclosed |
| CN-110511345-A | A kind of mould proof antistatic aerosil polyurethane composite thermal insulation wallboard | BAI ZHONGHUA | 2019-11-29 | — | — | CN | disclosed |
| CN-106458926-A | Pyridazinone herbicides | 杜邦公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-101970420-B | Oxadiazole derivatives | MERCK SERONO SA | 2014-09-24 | — | — | CN | disclosed |
| CN-101918395-B | Triazole oxadiazole derivatives | MERCK SERONO SA | 2014-04-16 | — | — | CN | disclosed |
| WO-2012111995-A1 | OXIME DERIVATIVES AS GPR119 AGONISTS | LG LIFE SCIENCES LTD. (KR) | 2012-08-23 | — | — | WO | disclosed |
| CN-101970420-A | Oxadiazole derivatives | MERCK SERONO SA | 2011-02-09 | — | — | CN | disclosed |
| CN-101918395-A | Triazole oxadiazole derivatives | MERCK SERONO SA | 2010-12-15 | — | — | CN | disclosed |
| CN-100429210-C | Substituted 6h-dibenzo[c,h]chromenes as estrogenic agents | WYETH CORP (US) | 2008-10-29 | — | — | CN | disclosed |
| EP-1311475-B1 | AMINOCYCLOHEXANE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-08-06 | — | — | EP | disclosed |
| CN-1125880-C | Method for processing mycobacteria | INTEGRATED RES TECH PLC (US) | 2003-10-29 | — | — | CN | disclosed |
| EP-1311475-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-21 | — | — | EP | disclosed |
| US-20020045777-A1 | 2,3-oxidosqualene-lanosterol cyclase inhibitors | F.HOFFMANN-LA ROCHE AG (CH) | 2002-04-18 | — | — | US | disclosed |
| WO-2002014267-A1 | NOVEL AMINOCYCLOHEXANE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-21 | — | — | WO | disclosed |
| CN-1046295-C | Polyurethane, process for producing the same, and process for producing polyurethane foam | KAO CORP (JP) | 1999-11-10 | — | — | CN | disclosed |
| CN-1045613-C | Polyurethane, process for producing the same, and process for producing polyurethane form | KAO CORP (JP) | 1999-10-13 | — | — | CN | disclosed |
| CN-1150460-A | Method for processing mycobacteria | CORNING CLINICAL LAB INC (US) | 1997-05-21 | — | — | CN | disclosed |
| CN-1120554-A | Polyurethane, process for producing the same, and process for producing polyurethane form | KAO CORP (JP) | 1996-04-17 | — | — | CN | disclosed |
| CN-1061979-A | Polyurethane, process for producing the same, and process for producing polyurethane foam | KAO CORP (JP) | 1992-06-17 | — | — | CN | disclosed |
| US-3989640-A | SYNERGISTIC, MORPHOLINE, AMMONIUM BENZOATE AND CYCLOHEXANE OR NITROPROPANE OR CYCLOPENTENE | THE DRACKETT COMPANY (US) | 1976-11-02 | — | — | US | disclosed |