⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3406050 | 0.76 | — | — | |
| SCHEMBL18716572 | 0.74 | ADORA3 (0.31) | — | |
| SCHEMBL6134852 | 0.72 | GAA (0.38) | — | |
| SCHEMBL189387 | 0.67 | — | — | |
| SCHEMBL3591108 | 0.67 | — | — | |
| SCHEMBL18880910 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL11210256 | 0.65 | — | — | |
| SCHEMBL13825937 | 0.64 | PDK2 (0.34) | — | |
| SCHEMBL6134707 | 0.64 | — | — | |
| SCHEMBL18721826 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005082414-A2 | CONCOMITANT DRUGS OF A SULFONAMIDE AND ANOTHER THERAPEUTIC AGENT | ASTELLAS PHARMA INC. (JP) | 2005-09-09 | — | — | WO | disclosed |
| US-20050197376-A1 | Concomitant drugs | FUJISAWA PHARMACEUTICAL CO. LTD. (JP) | 2005-09-08 | — | — | US | disclosed |