⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26434258 | 0.97 | — | — | |
| SCHEMBL22326593 | 0.75 | TAAR1 (0.38) | — | |
| SCHEMBL22113495 | 0.71 | — | — | |
| SCHEMBL10293214 | 0.71 | MAOA (0.39) | — | |
| SCHEMBL822287 | 0.69 | ALDH1A1 (0.42) | — | |
| SCHEMBL12792105 | 0.62 | TDP1 (0.36) | — | |
| SCHEMBL10007491 | 0.61 | ESR1 (0.54) | — | |
| SCHEMBL11947073 | 0.61 | ALDH1A1 (0.39) | — | |
| SCHEMBL13564394 | 0.59 | MAPT (0.54) | — | |
| SCHEMBL23925952 | 0.58 | NPSR1 (0.57) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020031958-A1 | PHOTOSENSITIVE RESIN COMPOSITION, PHOTOSENSITIVE SHEET, CURED FILMS OF THESE PRODUCTS AND METHODS FOR PRODUCING SAID CURED FILMS, AND ELECTRONIC COMPONENT | 東レ株式会社 | 2020-02-13 | — | — | WO | disclosed |