⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28233046 | 0.91 | ALDH1A1 (0.32) | — | |
| SCHEMBL7263173 | 0.83 | MGAM (0.39) | — | |
| SCHEMBL13268373 | 0.81 | — | — | |
| SCHEMBL1153941 | 0.80 | — | — | |
| SCHEMBL9839492 | 0.80 | ALDH1A1 (0.50) | — | |
| SCHEMBL9710509 | 0.80 | — | — | |
| SCHEMBL4897752 | 0.79 | KMT2A (0.39) | — | |
| SCHEMBL27353580 | 0.79 | — | — | |
| SCHEMBL17439186 | 0.79 | MGAM (0.55) | — | |
| SCHEMBL19638975 | 0.79 | — | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107836475-A | A kind of long-acting insect repellant compositions, its preparation method and its application | 上海惠心化妆品有限公司 | 2018-03-27 | — | — | CN | claimed |
| EP-1756118-B1 | TETRAHYDROPYRIDOTHIOPHENES FOR USE IN THE TREATMENT OF CANCER | NYCOMED GMBH (DE) | 2008-05-28 | — | — | EP | claimed |
| CN-110049802-A | Structured compositions | 巴斯夫欧洲公司 | 2019-07-23 | — | — | CN | disclosed |
| CN-108348420-A | Structured compositions | 巴斯夫欧洲公司 | 2018-07-31 | — | — | CN | disclosed |
| CN-107445964-A | A kind of synthetic method of Vardenafil hydrochloric acid impurity | 合肥创新医药技术有限公司 | 2017-12-08 | — | — | CN | disclosed |
| CN-107249553-A | Compositions comprising carbohydrate partial esters | 巴斯夫欧洲公司 | 2017-10-13 | — | — | CN | disclosed |
| CN-104266984-B | A kind of spectrophotometric method of quick detection ethyl carbamate content | 江南大学 | 2016-08-17 | — | — | CN | disclosed |
| CN-105820064-A | Synthetic method of biphenylyl alaninol derivative and intermediate | 浙江天宇药业股份有限公司 | 2016-08-03 | — | — | CN | disclosed |
| CN-104266984-A | Spectrophotometric method for quickly detecting content of ethyl carbamate | UNIV JIANGNAN | 2015-01-07 | — | — | CN | disclosed |
| CN-102735830-A | Preparation method for ethyl urethane detection test paper and detection method of test paper | UNIV ZHEJIANG A & F | 2012-10-17 | — | — | CN | disclosed |
| CN-101228135-B | Pyridazinone derivatives as thyroid hormone receptor agonists | HOFFMANN LA ROCHE | 2011-08-31 | — | — | CN | disclosed |
| CN-1228337-C | Carbamic acid derivs. and their use as metabotropic glutamate receptor ligands | HOFFMANN LA ROCHE (CH) | 2005-11-23 | — | — | CN | disclosed |
| CN-1086697-C | Substituted 2-aryl-1, 2, 4-triazine-3, 5-di (thio) ketones as herbicides | BAYER AG (DE) | 2002-06-26 | — | — | CN | disclosed |
| CN-1347811-A | Ink jet recording paper | PRINCE PAPERMAKING CO LTD (JP) | 2002-05-08 | — | — | CN | disclosed |
| CN-1347406-A | Carbamic acid derivs. and their use as metabotropic glutamate receptor ligands | HOFFMANN LA ROCHE (CH) | 2002-05-01 | — | — | CN | disclosed |
| CN-1216538-A | Substituted 2-aryl-1,2,4-triazine-3,5-di(thi) ones as herbicides | BAYER AG (DE) | 1999-05-12 | — | — | CN | disclosed |
| CN-1122577-A | Radiolabeled platelet GPIIb/IIIa receptor antagonists as imaging agents for the diagnosis of thromboembolic disorders | DU PONT MERCK PHARMA (US) | 1996-05-15 | — | — | CN | disclosed |
| CN-1105699-A | Colour flame candle and its manufacturing method | XI AN ENERGY SOURCE & WATER TR (CN) | 1995-07-26 | — | — | CN | disclosed |
| CN-1105699-A | Colour flame candle and its manufacturing method | XI AN ENERGY SOURCE & WATER TR (CN) | 1995-07-26 | — | — | CN | disclosed |
| CN-85108193-A | Contain weedicide of aryl triazolineone and preparation method thereof | — | 1986-12-17 | — | — | CN | disclosed |