⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6420177 | 0.73 | — | — | |
| SCHEMBL11514866 | 0.71 | — | — | |
| SCHEMBL6416320 | 0.69 | ESR1 (0.32) | — | |
| SCHEMBL16860563 | 0.67 | — | — | |
| SCHEMBL7872983 | 0.65 | — | — | |
| SCHEMBL1686599 | 0.64 | — | — | |
| SCHEMBL18660209 | 0.64 | — | — | |
| SCHEMBL8015874 | 0.64 | — | — | |
| SCHEMBL7997460 | 0.64 | — | — | |
| SCHEMBL31142105 | 0.63 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102558107-B | Process for preparing tris (tetrahydrofuran)-trihalogenated chromium and application thereof for preparing olefin oligomerization catalyst | CHINA PETROLEUM & CHEMICAL | 2015-04-29 | — | — | CN | claimed |
| CN-102558107-A | Process for preparing tris (tetrahydrofuran)-trihalogenated chromium and application thereof for preparing olefin oligomerization catalyst | CHINA PETROLEUM & CHEMICAL | 2012-07-11 | — | — | CN | claimed |
| CN-108136549-A | Thixotropic agent, flux containing thixotropic agent, and solder paste | 共荣社化学株式会社 | 2018-06-08 | — | — | CN | disclosed |
| CN-102558107-B | Process for preparing tris (tetrahydrofuran)-trihalogenated chromium and application thereof for preparing olefin oligomerization catalyst | CHINA PETROLEUM & CHEMICAL | 2015-04-29 | — | — | CN | disclosed |
| CN-103102237-B | Method for improving performance of ethylene trimerization catalyst | CHINA PETROLEUM & CHEMICAL | 2015-02-11 | — | — | CN | disclosed |
| CN-103896712-A | Preparation method of butyne | TIANJIN TAIHENG GASES CO LTD | 2014-07-02 | — | — | CN | disclosed |
| CN-103102237-A | Method for improving performance of ethylene trimerization catalyst | CHINA PETROLEUM & CHEMICAL | 2013-05-15 | — | — | CN | disclosed |
| CN-102558107-A | Process for preparing tris (tetrahydrofuran)-trihalogenated chromium and application thereof for preparing olefin oligomerization catalyst | CHINA PETROLEUM & CHEMICAL | 2012-07-11 | — | — | CN | disclosed |
| US-20050066453-A1 | Photochromic dye | NEW PRISMATIC ENTERPRISE CO., LTD. (TW) | 2005-03-31 | — | — | US | disclosed |