⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2876407 | 0.98 | FOLH1 (0.30) | — | |
| SCHEMBL2878198 | 0.98 | FOLH1 (0.30) | — | |
| SCHEMBL2876022 | 0.94 | TDP1 (0.30) | — | |
| SCHEMBL9751198 | 0.86 | HSPA5 (0.39) | — | |
| SCHEMBL2875695 | 0.85 | TDP1 (0.32) | — | |
| SCHEMBL6684264 | 0.84 | CTNNB1 (0.45) | — | |
| SCHEMBL6685436 | 0.83 | CTNNB1 (0.44) | — | |
| SCHEMBL6681399 | 0.83 | CTNNB1 (0.44) | — | |
| SCHEMBL6689791 | 0.82 | TDP1 (0.41) | — | |
| SCHEMBL6685311 | 0.80 | TDP1 (0.40) | — |
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-20100151392-A1 | ANTIREFLECTIVE COATING COMPOSITIONS | RAHMAN M DALIL | 2010-06-17 | — | — | US | disclosed |