⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20109731 | 0.95 | MEN1 (0.39) | — | |
| SCHEMBL13096717 | 0.92 | TSHR (0.41) | — | |
| SCHEMBL16640337 | 0.90 | GBA1 (0.44) | — | |
| SCHEMBL322260 | 0.86 | — | — | |
| SCHEMBL4614051 | 0.86 | TSHR (0.47) | — | |
| SCHEMBL7512016 | 0.84 | TDP1 (0.36) | — | |
| SCHEMBL10072541 | 0.84 | TSHR (0.61) | — | |
| SCHEMBL18902542 | 0.83 | TSHR (0.50) | — | |
| SCHEMBL1164544 | 0.81 | GBA1 (0.49) | — | |
| SCHEMBL2683407 | 0.81 | TSHR (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180119063-A1 | LEUCO POLYMERS AS BLUING AGENTS IN LAUNDRY CARE COMPOSITIONS | THE PROCTER & GAMBLE COMPANY | 2018-05-03 | — | — | US | disclosed |
| EP-1438295-B1 | AZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MERCK SERONO SA (CH) | 2012-08-15 | — | — | EP | disclosed |
| EP-1912645-A2 | THERAPEUTIC AGENT FOR DIABETES | Takeda Pharmaceutical Company Limited (JP) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007018314-A2 | THERAPEUTIC AGENT FOR DIABETES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-02-15 | — | — | WO | disclosed |