⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2148957 | 0.67 | — | — | |
| Lithium SCHEMBL11499803 | 0.64 | — | — | |
| SCHEMBL667876 | 0.58 | — | — | |
| SCHEMBL668925 | 0.58 | — | — | |
| SCHEMBL925480 | 0.58 | — | — | |
| SCHEMBL2427181 | 0.58 | — | — | |
| SCHEMBL9806538 | 0.58 | — | — | |
| SCHEMBL175597 | 0.58 | — | — | |
| SCHEMBL169060 | 0.58 | — | — | |
| Butadiene SCHEMBL10763042 | 0.55 | TRPA1 (0.36) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103998679-B | Method for coating a textile | 拜耳知识产权有限责任公司 | 2016-06-15 | — | — | CN | claimed |
| CN-103998679-B | Method for coating a textile | 拜耳知识产权有限责任公司 | 2016-06-15 | — | — | CN | disclosed |
| US-20030145763-A1 | Flocculant or binder composition, slurry containing the flocculant or binder composition, method for making ceramics using the slurry, and ceramic products made therefrom | GRULL DIETMAR (AT) | 2003-08-07 | — | — | US | disclosed |
| EP-0187281-B1 | NOVEL CARBOXYLATE POLYMERS AND PROCESSES FOR THEIR PREPARATION AND USE | RHONE-POULENC SPECIALTY CHEMICALS CO. (US) | 1993-06-23 | — | — | EP | disclosed |
| US-5006125-A | Scouring with aqueous sodium hydroxide, steaming, treating with quaternary ammonium compound having epoxy group | THE DOW CHEMICAL COMPANY (US) | 1991-04-09 | — | — | US | disclosed |
| US-4808668-A | SEWAGE TREATMENT FLOCCULANT | ALLIED-SIGNAL INC. (US) | 1989-02-28 | — | — | US | disclosed |