⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6192609 | 0.75 | — | — | |
| SCHEMBL18287713 | 0.75 | — | — | |
| SCHEMBL567661 | 0.73 | PRSS1 (0.32) | — | |
| SCHEMBL9971730 | 0.68 | CA1 (0.30) | — | |
| SCHEMBL15871607 | 0.68 | CA1 (0.30) | — | |
| SCHEMBL4382760 | 0.68 | CA1 (0.30) | — | |
| SCHEMBL14752080 | 0.64 | — | — | |
| SCHEMBL23960686 | 0.62 | PRSS1 (0.31) | — | |
| SCHEMBL20625926 | 0.62 | PRSS1 (0.31) | — | |
| SCHEMBL21181782 | 0.62 | PRSS1 (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3434710-A1 | POLY(LACTIC ACID) RESIN COMPOSITION AND MOLDED PRODUCT COMPRISING SAME | SK Chemicals Co., Ltd. (KR) | 2019-01-30 | — | — | EP | disclosed |