⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL8841037 | 0.80 | — | — | |
| Benzene SCHEMBL27282100 | 0.68 | TP53 (0.43) | — | |
| Benzene SCHEMBL28927988 | 0.60 | TP53 (0.33) | — | |
| Benzene SCHEMBL28112029 | 0.60 | TP53 (0.33) | — | |
| Benzene SCHEMBL5194700 | 0.60 | TP53 (0.33) | — | |
| Benzene SCHEMBL73337 | 0.60 | TP53 (0.33) | — | |
| Benzene SCHEMBL1821858 | 0.60 | CA1 (0.67) | — | |
| Benzene SCHEMBL8233367 | 0.60 | — | — | |
| Benzene SCHEMBL6360513 | 0.60 | TP53 (0.33) | — | |
| Benzene SCHEMBL11672180 | 0.57 | TP53 (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-20020039701-A1 | Resist composition and patterning process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-04-04 | — | — | US | disclosed |
| EP-1136885-A1 | Chemically amplified positive resist composition and patterning method | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2001-09-26 | — | — | EP | disclosed |