⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9501448 | 0.80 | — | — | |
| SCHEMBL1634351 | 0.70 | ALDH1A1 (0.38) | — | |
| SCHEMBL1634353 | 0.70 | ALDH1A1 (0.38) | — | |
| SCHEMBL6589804 | 0.69 | — | — | |
| SCHEMBL6589810 | 0.69 | — | — | |
| SCHEMBL29165025 | 0.67 | — | — | |
| SCHEMBL18556897 | 0.67 | GABRR1 (0.30) | — | |
| SCHEMBL24932434 | 0.66 | — | — | |
| SCHEMBL15524650 | 0.66 | — | — | |
| SCHEMBL21076313 | 0.66 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115612000-A | Infrared light sensitive photo-curing composition | 保定乐凯新材料股份有限公司 | 2023-01-17 | — | — | CN | disclosed |
| EP-3325446-A1 | SUBSTITUTED ARYL AND HETEROARYL CARBOXYLIC ACID HYDRAZIDES OR SALTS THEREOF AND USE THEREOF TO INCREASE STRESS TOLERANCE IN PLANTS | Bayer CropScience Aktiengesellschaft (DE) | 2018-05-30 | — | — | EP | disclosed |
| EP-3322774-A1 | USE OF CORROSION INHIBITORS FOR FUELS AND LUBRICANTS | BASF SE (DE) | 2018-05-23 | — | — | EP | disclosed |