⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL112049 | 0.70 | — | — | |
| SCHEMBL28159402 | 0.70 | — | — | |
| SCHEMBL762779 | 0.70 | — | — | |
| SCHEMBL2803526 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL3750317 | 0.67 | — | — | |
| SCHEMBL16326564 | 0.67 | — | — | |
| SCHEMBL2406400 | 0.67 | — | — | |
| SCHEMBL4882 | 0.67 | — | — | |
| SCHEMBL3032456 | 0.67 | — | — | |
| SCHEMBL1577819 | 0.67 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2003506426-A | — | — | 2003-02-18 | — | — | JP | claimed |
| EP-1202953-A2 | SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES | Grünenthal GmbH (DE) | 2002-05-08 | — | — | EP | claimed |
| WO-2001010816-A2 | SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES | Grünenthal GmbH (DE) | 2001-02-15 | — | — | WO | claimed |
| US-5859241-A | Process for the preparation of a benzothiazepine | DSM N.V. (NL) | 1999-01-12 | — | — | US | claimed |
| CN-109678782-A | A kind of preparation method of indoles -4- methyl formate | 河南中医药大学 | 2019-04-26 | — | — | CN | disclosed |
| WO-2017054112-A1 | METHOD OF PREPARING 3-FLUOROALKYL-1-METHYLPYRAZOLE-4-CARBOXYLIC ACID | 常州市卜弋科研化工有限公司 | 2017-04-06 | — | — | WO | disclosed |
| EP-1270643-B1 | PROCESS FOR PREPARING FUNCTIONAL POLYPHENYLENE ETHER RESINS | ASAHI CHEMICAL IND (JP) | 2007-06-13 | — | — | EP | disclosed |
| US-6835795-B2 | Proton nuclear magnetic resonance spectrum with a peak area ratio (a)/(b) of >/= .0001, a is the area of peaks at chemical shifts from 2.95-3.04 ppm, and b is the area of peaks at chemical shifts from 6.00-6.90 ppm | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2004-12-28 | — | — | US | disclosed |
| US-20030130474-A1 | Proton nuclear magnetic resonance spectrum with a peak area ratio (a)/(b) of >/= .0001, a is the area of peaks at chemical shifts from 2.95-3.04 ppm, and b is the area of peaks at chemical shifts from 6.00-6.90 ppm | ASAHI KASEI KABUSHIKI KAISHA (JP) | 2003-07-10 | — | — | US | disclosed |
| EP-1270643-A1 | FUNCTIONAL POLYPHENYLENE ETHER RESIN | Asahi Kasei Kabushiki Kaisha (JP) | 2003-01-02 | — | — | EP | disclosed |
| US-RE37873-E1 | Phenylacetic acid derivatives, preparation thereof and intermediates therefor, and compositions containing them | BASF AKTIENGESELLSCHAFT (DE) | 2002-10-08 | — | — | US | disclosed |
| EP-1202953-A2 | SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES | Grünenthal GmbH (DE) | 2002-05-08 | — | — | EP | disclosed |
| WO-2001010816-A2 | SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES | Grünenthal GmbH (DE) | 2001-02-15 | — | — | WO | disclosed |
| US-6187812-B1 | FOR CONTROLLING ANIMAL PESTS OR HARMFUL FUNGI; (E,E,E)-2-METHOXYIMINO-2-(2'-(1?-METHYL, 1?-(1?'-ETHOXYIMINOETHYL))IMINOOXYMETHYL)PHENYLACETIC ACID MONOMETHYLAMIDE, FOR EXAMPLE | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-13 | — | — | US | disclosed |