⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15219186 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL18850238 | 0.69 | — | — | |
| SCHEMBL23963254 | 0.67 | — | — | |
| SCHEMBL14204553 | 0.65 | — | — | |
| SCHEMBL14204562 | 0.65 | POLB (0.30) | — | |
| SCHEMBL18758061 | 0.65 | — | — | |
| SCHEMBL29384885 | 0.63 | — | — | |
| SCHEMBL12764854 | 0.62 | — | — | |
| SCHEMBL19818784 | 0.62 | TSHR (0.30) | — | |
| SCHEMBL75137 | 0.62 | ALDH1A1 (0.30) | — |
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-10007178-B2 | Positive resist composition and patterning process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2018-06-26 | — | — | US | disclosed |
| US-20170130071-A1 | CONDUCTIVE MATERIAL AND SUBSTRATE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-05-11 | — | — | US | disclosed |