⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6122804 | 0.98 | — | — | |
| SCHEMBL27514353 | 0.87 | ESR1 (0.31) | — | |
| SCHEMBL28236208 | 0.85 | DPP4 (0.33) | — | |
| SCHEMBL28186420 | 0.85 | ESR1 (0.32) | — | |
| SCHEMBL27285194 | 0.81 | DPP4 (0.37) | — | |
| SCHEMBL28247202 | 0.80 | — | — | |
| SCHEMBL179791 | 0.79 | DPP4 (0.38) | — | |
| SCHEMBL19466455 | 0.79 | KMT2A (0.33) | — | |
| SCHEMBL25281081 | 0.78 | SLC6A3 (0.42) | — | |
| SCHEMBL2143236 | 0.78 | — | — |
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-106176301-A | Dermal compositions and using method thereof | 奥利沃实验室有限责任公司 | 2016-12-07 | — | — | CN | claimed |
| CN-106176301-A | Dermal compositions and using method thereof | 奥利沃实验室有限责任公司 | 2016-12-07 | — | — | CN | disclosed |
| CN-103153279-B | Skin compositions and methods of use thereof | 奥利沃实验室有限责任公司 | 2016-10-12 | — | — | CN | disclosed |