⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL703093 | 0.86 | SCN4A (0.38) | — | |
| SCHEMBL15673356 | 0.74 | HTR2A (0.33) | — | |
| SCHEMBL10497077 | 0.71 | TRPA1 (0.38) | — | |
| SCHEMBL25413674 | 0.69 | TDP1 (0.30) | — | |
| SCHEMBL7889952 | 0.69 | DPP4 (0.32) | — | |
| SCHEMBL6499230 | 0.69 | SRD5A2 (0.49) | — | |
| SCHEMBL433140 | 0.69 | DPP4 (0.39) | — | |
| SCHEMBL6311924 | 0.69 | LTA4H (0.43) | — | |
| SCHEMBL4452437 | 0.68 | PBRM1 (0.35) | — | |
| SCHEMBL2086755 | 0.67 | PBRM1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11090253-B2 | Cosmetic composition comprising silicone materials | DOW SILICONES CORPORATION (US) | 2021-08-17 | — | — | US | disclosed |
| US-20200214967-A1 | COSMETIC COMPOSITION COMPRISING SILICONE MATERIALS | DOW SILICONES CORPORATION | 2020-07-09 | — | — | US | disclosed |