⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5158336 | 0.73 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL7067134 | 0.69 | CA12 (0.38) | — | |
| SCHEMBL11602243 | 0.67 | — | — | |
| SCHEMBL279830 | 0.60 | — | — | |
| SCHEMBL27599974 | 0.59 | SMN1; SMN2 (0.67) | — | |
| SCHEMBL9250862 | 0.58 | KEAP1 (0.34) | — | |
| SCHEMBL28749872 | 0.58 | KMT2A (0.63) | — | |
| Potassium SCHEMBL30668585 | 0.58 | — | — | |
| SCHEMBL27582562 | 0.57 | MAPT (0.62) | — | |
| SCHEMBL27582541 | 0.57 | KMT2A (0.61) | — |
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-RE29834-E | PREPARED FROM 4-SULFONYL-1,8-NAPHTHOLACTAMS | BAYER AKTIENGESELLSCHAFT (DE) | 1978-11-14 | — | — | US | claimed |