⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1325744 | 0.93 | EPHX1 (0.64) | — | |
| SCHEMBL590532 | 0.81 | EPHX1 (0.59) | — | |
| SCHEMBL16824229 | 0.81 | EPHX1 (0.59) | — | |
| SCHEMBL383296 | 0.79 | — | — | |
| SCHEMBL968307 | 0.79 | — | — | |
| SCHEMBL6866097 | 0.78 | EPHX1 (0.52) | — | |
| SCHEMBL1170767 | 0.77 | — | — | |
| SCHEMBL11411528 | 0.77 | ACHE (0.64) | — | |
| SCHEMBL18553837 | 0.77 | — | — | |
| SCHEMBL1681540 | 0.77 | — | — |
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-1040189-A1 | POLYPEPTIDES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 2000-10-04 | — | — | EP | disclosed |
| EP-1001989-A1 | PROLACTIN SECRETION MODULATOR | Takeda Chemical Industries, Ltd. (JP) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999033976-A1 | POLYPEPTIDE, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-07-08 | — | — | WO | disclosed |
| WO-1998058962-A1 | PROLACTIN SECRETION MODULATOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-12-30 | — | — | WO | disclosed |