⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9535919 | 1.00 | — | — | |
| SCHEMBL9533419 | 0.75 | ALDH1A1 (0.54) | — | |
| SCHEMBL9533427 | 0.72 | ALDH1A1 (0.36) | — | |
| Iodide SCHEMBL9540246 | 0.68 | — | — | |
| Iodide SCHEMBL10782561 | 0.65 | — | — | |
| SCHEMBL9763644 | 0.64 | — | — | |
| SCHEMBL14814579 | 0.61 | — | — | |
| SCHEMBL18760759 | 0.60 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL15803701 | 0.59 | KDM4E (0.32) | — | |
| SCHEMBL13385439 | 0.59 | — | — |
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-0182262-B1 | NONA AND DECAPEPTIDE ANALOGS OF LHRH USEFUL AS LHRH ANTAGONISTS | SYNTEX (U.S.A.) INC. (US) | 1993-01-20 | — | — | EP | disclosed |
| US-4690916-A | ANTIFERTILITY AGENTS; HALO-SUBSTITUTED GUANADINO AMINO ACYL RESIDUE COMPONENT | SYNTEX (U.S.A.) INC. (US) | 1987-09-01 | — | — | US | disclosed |
| EP-0182262-A2 | Nona and decapeptide analogs of LHRH useful as LHRH antagonists | SYNTEX (U.S.A.) INC. (US) | 1986-05-28 | — | — | EP | disclosed |