⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9112765 | 0.83 | SIGMAR1 (0.33) | — | |
| SCHEMBL8843698 | 0.77 | SIGMAR1 (0.33) | — | |
| SCHEMBL9112697 | 0.75 | CHEK1 (0.41) | — | |
| SCHEMBL4979062 | 0.74 | GRIN2D (0.42) | — | |
| SCHEMBL6155369 | 0.74 | SIGMAR1 (0.31) | — | |
| SCHEMBL6727937 | 0.73 | SIGMAR1 (0.56) | — | |
| Hydrochloric Acid SCHEMBL8714228 | 0.72 | SIGMAR1 (0.54) | — | |
| SCHEMBL6156344 | 0.71 | — | — | |
| SCHEMBL6154831 | 0.71 | KDM4E (0.40) | — | |
| SCHEMBL4982970 | 0.71 | GRIN2D (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0918460-A1 | METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1999-06-02 | — | — | EP | disclosed |
| WO-1998004131-A1 | METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS | CAMBRIDGE NEUROSCIENCE, INC. (US) | 1998-02-05 | — | — | WO | disclosed |