⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23800910 | 0.91 | — | — | |
| SCHEMBL29565070 | 0.91 | — | — | |
| SCHEMBL17089913 | 0.88 | — | — | |
| SCHEMBL15038069 | 0.88 | — | — | |
| SCHEMBL19901121 | 0.82 | MAPT (0.30) | — | |
| SCHEMBL12202754 | 0.81 | — | — | |
| SCHEMBL12285096 | 0.81 | — | — | |
| SCHEMBL9880232 | 0.81 | — | — | |
| SCHEMBL9880234 | 0.80 | — | — | |
| SCHEMBL9882511 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9904074-B2 | Pupil-only photochromic contact lenses displaying desirable optics and comfort | JOHNSON & JOHNSON VISION CARE, INC. (US) | 2018-02-27 | — | — | US | disclosed |