⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13992734 | 0.82 | — | — | |
| SCHEMBL9818144 | 0.80 | KCNH3 (0.38) | — | |
| SCHEMBL13439132 | 0.79 | KCNH3 (0.33) | — | |
| SCHEMBL3388384 | 0.76 | — | — | |
| SCHEMBL1927524 | 0.76 | — | — | |
| SCHEMBL24996046 | 0.76 | — | — | |
| SCHEMBL16115353 | 0.76 | — | — | |
| SCHEMBL2738310 | 0.76 | — | — | |
| SCHEMBL12722834 | 0.76 | — | — | |
| SCHEMBL464628 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2157477-A1 | RESIST COMPOSITION FOR NEGATIVE WORKING-TYPE DEVELOPMENT, AND METHOD FOR PATTERN FORMATION USING THE RESIST COMPOSITION | Fujifilm Corporation (JP) | 2010-02-24 | — | — | EP | disclosed |
| CN-1035876-C | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO LTD (JP) | 1997-09-17 | — | — | CN | disclosed |
| CN-1079739-A | Tetrahydrothiophene derivatives | SANTEN PHARMACEUTICAL CO LTD (JP) | 1993-12-22 | — | — | CN | disclosed |
| US-4613613-A | ANTIARTHRITIC AGENTS | MITSUBISHI YUKA PHARMACEUTICAL CO., LTD. (JP) | 1986-09-23 | — | — | US | disclosed |