⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3793435 | 0.71 | — | — | |
| SCHEMBL8988872 | 0.62 | — | — | |
| SCHEMBL12601793 | 0.62 | — | — | |
| SCHEMBL12154070 | 0.62 | — | — | |
| SCHEMBL7656436 | 0.59 | — | — | |
| SCHEMBL5252500 | 0.59 | — | — | |
| SCHEMBL7849746 | 0.57 | — | — | |
| SCHEMBL17760163 | 0.57 | — | — | |
| SCHEMBL13651618 | 0.57 | — | — | |
| SCHEMBL4801599 | 0.56 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105622526-A | Preparation method of 2-aminopyrazine derivatives | UNIV HUBEI TECHNOLOGY | 2016-06-01 | — | — | CN | claimed |
| CN-106674208-B | The polycarboxylic preparation method of 2,2 '-N, N- double pyrazole base biphenyl | 洛阳师范学院 | 2019-03-05 | — | — | CN | disclosed |
| CN-108203433-A | A kind of ROCK inhibitor and its application | 成都先导药物开发有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-106674208-A | Preparation method of 2,2'-N,N-bis-pyrazolyl biphenyl polycarboxylic acid | 洛阳师范学院 | 2017-05-17 | — | — | CN | disclosed |
| CN-105622526-A | Preparation method of 2-aminopyrazine derivatives | UNIV HUBEI TECHNOLOGY | 2016-06-01 | — | — | CN | disclosed |
| CN-104902749-A | Method for promoting plant growth | SUMITOMO CHEMICAL CO | 2015-09-09 | — | — | CN | disclosed |
| CN-104902751-A | Method for promoting plant growth | SUMITOMO CHEMICAL CO | 2015-09-09 | — | — | CN | disclosed |
| CN-104902752-A | Method for promoting plant growth | SUMITOMO CHEMICAL CO | 2015-09-09 | — | — | CN | disclosed |
| CN-104902750-A | Method for promoting plant growth | SUMITOMO CHEMICAL CO | 2015-09-09 | — | — | CN | disclosed |
| WO-2008064830-A1 | BICYCLIC AND HETEROBICYCLIC DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR PHARMACEUTICAL USES | UCB PHARMA, S.A. (BE) | 2008-06-05 | — | — | WO | disclosed |