⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26627989 | 0.95 | HTT (0.31) | — | |
| SCHEMBL26627931 | 0.94 | KDM4E (0.31) | — | |
| SCHEMBL25600636 | 0.94 | HTT (0.30) | — | |
| SCHEMBL25600051 | 0.91 | PDK2 (0.30) | — | |
| SCHEMBL25600720 | 0.91 | — | — | |
| SCHEMBL25600724 | 0.89 | — | — | |
| SCHEMBL25600296 | 0.89 | KDM4E (0.33) | — | |
| SCHEMBL26512807 | 0.89 | — | — | |
| SCHEMBL26512803 | 0.88 | MAPT (0.32) | — | |
| SCHEMBL25604114 | 0.88 | PGR (0.32) | — |
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-20230340318-A1 | PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES | HOYA LENS THAILAND LTD. (TH) | 2023-10-26 | — | — | US | disclosed |
| US-20230340318-A1 | PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES | HOYA LENS THAILAND LTD. (TH) | 2023-10-26 | — | — | US | disclosed |