⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11918120 | 0.78 | — | — | |
| SCHEMBL23287923 | 0.78 | — | — | |
| SCHEMBL14424438 | 0.75 | — | — | |
| SCHEMBL1828790 | 0.75 | — | — | |
| SCHEMBL2467648 | 0.75 | ALDH1A1 (0.35) | — | |
| SCHEMBL2462968 | 0.75 | — | — | |
| SCHEMBL14754476 | 0.75 | — | — | |
| SCHEMBL763723 | 0.75 | — | — | |
| SCHEMBL10970507 | 0.75 | — | — | |
| SCHEMBL17961640 | 0.75 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107082735-B | Method for preparing 2,4, 4-trimethyl-1-pentene | 万华化学集团股份有限公司 | 2020-06-02 | — | — | CN | claimed |
| CN-107082735-A | A kind of method for preparing the amylene of 2,4,4 trimethyl 1 | 万华化学集团股份有限公司 | 2017-08-22 | — | — | CN | claimed |
| CN-107082735-B | Method for preparing 2,4, 4-trimethyl-1-pentene | 万华化学集团股份有限公司 | 2020-06-02 | — | — | CN | disclosed |
| CN-107082735-A | A kind of method for preparing the amylene of 2,4,4 trimethyl 1 | 万华化学集团股份有限公司 | 2017-08-22 | — | — | CN | disclosed |
| CN-103124734-B | Hydrosilane derivative, method for producing same, and method for producing silicon-containing thin film | TOSOH CORP | 2015-07-15 | — | — | CN | disclosed |
| WO-2007058628-A1 | HETEROALKYL LINKED PYRIMIDINE DERIVATIVES | S*BIO PTE LTD (SG) | 2007-05-24 | — | — | WO | disclosed |
| US-5525449-A | ALSO CONTAINING THERMOPLASTIC RESIN PARTICLES, PIGMENT AND CHARGE DIRECTOR CONTAINING METHANOL, ETHANOL, PROPANOL, BUTANOL OR PENTANOL | XEROX CORPORATION (US) | 1996-06-11 | — | — | US | disclosed |
| US-5459007-A | Liquid developer compositions with block copolymers | XEROX CORPORATION | 1995-10-17 | — | — | US | disclosed |
| US-5441841-A | A nonpolar liquid soluble charge director comprised of an ionic or zwitterionic quaternary ammonium block copolymer | XEROX CORPORATION (US) | 1995-08-15 | — | — | US | disclosed |
| US-5407775-A | Liquid developer compositions with block copolymers | XEROX CORPORATION (US) | 1995-04-18 | — | — | US | disclosed |
| EP-0209574-B1 | METHOD FOR PREPARING COPPER-DIAMINE COMPLEXES AND DIAMINES | GENERAL ELECTRIC COMPANY (US) | 1988-06-01 | — | — | EP | disclosed |
| US-4595773-A | Method for preparing copper-diamine complexes and diamines | GENERAL ELECTRIC COMPANY (US) | 1986-06-17 | — | — | US | disclosed |