⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1882577 | 0.81 | — | — | |
| SCHEMBL2562270 | 0.79 | — | — | |
| SCHEMBL30017481 | 0.79 | — | — | |
| SCHEMBL2555205 | 0.79 | — | — | |
| SCHEMBL10525928 | 0.79 | TDP1 (0.50) | — | |
| SCHEMBL5077201 | 0.79 | — | — | |
| SCHEMBL19551977 | 0.79 | — | — | |
| SCHEMBL2515977 | 0.79 | TSHR (0.39) | — | |
| SCHEMBL6379379 | 0.77 | CTSK (0.39) | — | |
| SCHEMBL10403653 | 0.76 | TSHR (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0238352-B1 | METHOD FOR THE SELECTIVE DETECTION OF MICROBIAL NUCLEOTIDES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1993-06-23 | — | — | EP | disclosed |
| US-4906565-A | Method for the selective detection of microbial nucleotides | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1990-03-06 | — | — | US | disclosed |
| EP-0238352-A2 | Method for the selective detection of microbial nucleotides | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1987-09-23 | — | — | EP | disclosed |