⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11408483 | 0.87 | PLA2G2C (0.41) | — | |
| SCHEMBL19124751 | 0.80 | — | — | |
| SCHEMBL27990509 | 0.80 | LPAR3 (0.41) | — | |
| SCHEMBL8768479 | 0.78 | PLA2G2C (0.38) | — | |
| SCHEMBL63984 | 0.78 | BTN3A1 (0.53) | — | |
| SCHEMBL369043 | 0.78 | PLA2G2C (0.38) | — | |
| SCHEMBL302912 | 0.78 | — | — | |
| SCHEMBL12583935 | 0.78 | — | — | |
| SCHEMBL28611101 | 0.76 | LPAR3 (0.39) | — | |
| SCHEMBL30834684 | 0.76 | BTN3A1 (0.38) | — |
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-111273044-A | Method for evaluating temperature and humidity state of environment where nursery pig individual grows | 中国科学院亚热带农业生态研究所 | 2020-06-12 | — | — | CN | disclosed |
| CN-111208233-A | Method for evaluating temperature and humidity state of environment where nursery pig individual grows by using blood metabolites | 中国科学院亚热带农业生态研究所 | 2020-05-29 | — | — | CN | disclosed |
| CN-111208233-A | Method for evaluating temperature and humidity state of environment where nursery pig individual grows by using blood metabolites | 中国科学院亚热带农业生态研究所 | 2020-05-29 | — | — | CN | disclosed |