⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17975426 | 0.88 | — | — | |
| SCHEMBL17971267 | 0.75 | — | — | |
| SCHEMBL17971269 | 0.72 | — | — | |
| SCHEMBL17971272 | 0.71 | — | — | |
| SCHEMBL22451122 | 0.71 | — | — | |
| SCHEMBL22451047 | 0.70 | — | — | |
| SCHEMBL22036892 | 0.70 | — | — | |
| SCHEMBL17963026 | 0.68 | — | — | |
| SCHEMBL17971262 | 0.68 | — | — | |
| SCHEMBL11819876 | 0.60 | — | — |
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-9522975-B2 | Mercaptanized vinylnorbornene compositions and methods of making same | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2016-12-20 | — | — | US | disclosed |
| US-20160222155-A1 | Mercaptanized Vinylnorbornene Compositions and Methods of Making Same | CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) | 2016-08-04 | — | — | US | disclosed |