⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7641095 | 1.00 | — | — | |
| SCHEMBL43333 | 0.82 | — | — | |
| SCHEMBL27500154 | 0.82 | — | — | |
| SCHEMBL29622072 | 0.82 | — | — | |
| SCHEMBL724823 | 0.82 | — | — | |
| SCHEMBL7994735 | 0.82 | — | — | |
| SCHEMBL27414869 | 0.82 | — | — | |
| SCHEMBL13720141 | 0.67 | — | — | |
| SCHEMBL127312 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL7158975 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108553463-A | A kind of drug for treating Alzheimer disease | 巨德峰 | 2018-09-21 | — | — | CN | disclosed |
| CN-108484599-A | A kind of compound for treating Alzheimer disease | 巨德峰 | 2018-09-04 | — | — | CN | disclosed |
| CN-108358920-A | A kind of drug for treating Alzheimer disease | 巨德峰 | 2018-08-03 | — | — | CN | disclosed |
| CN-106795155-A | Process for the preparation of (4S) -4- (4-cyano-2-methoxyphenyl) -5-ethoxy-2, 8-dimethyl-1, 4-dihydro-1, 6-naphthyridine-3-carboxamide and purification thereof for use as active pharmaceutical active ingredient | 拜耳医药股份有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-1165533-C | Spiropiperidine derivatives | ������������ʽ���� | 2004-09-08 | — | — | CN | disclosed |
| CN-1311791-A | Prepn. of organolithium and organophosphorus derivatives | SHELL INT RESEARCH (NL) | 2001-09-05 | — | — | CN | disclosed |
| CN-1294588-A | Spiropiperidine derivatives | SANKYO CO (JP) | 2001-05-09 | — | — | CN | disclosed |
| US-6166260-A | Tandem reduction and host-guest complexation | ZEELAND CHEMICALS, INC. (US) | 2000-12-26 | — | — | US | disclosed |