⚠ 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 | |
|---|---|---|---|---|
| 2-Chloropyridine SCHEMBL9850322 | 0.97 | — | — | |
| 2-Chloropyridine SCHEMBL10690176 | 0.97 | TDP1 (1.00) | — | |
| 2-Chloropyridine SCHEMBL11389784 | 0.97 | — | — | |
| 2-Chloropyridine SCHEMBL29402311 | 0.97 | — | — | |
| 2-Chloropyridine SCHEMBL16637 | 0.97 | — | — | |
| 2-Chloropyridine SCHEMBL28283275 | 0.97 | TDP1 (1.00) | — | |
| 2-Chloropyridine SCHEMBL1935752 | 0.94 | — | — | |
| 2-Chloropyridine SCHEMBL457535 | 0.94 | — | — | |
| 2-Chloropyridine SCHEMBL11437985 | 0.94 | — | — | |
| 2-Chloropyridine SCHEMBL21640063 | 0.94 | — | — |
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-0677042-B1 | SELECTIVE LIGANDS OF 5HT1D-5HT1B RECEPTORS DERIVED FROM INDOLE-PIPERAZINE USEFUL AS MEDICAMENTS | PF MEDICAMENT (FR) | 1998-07-22 | — | — | EP | disclosed |
| EP-0677042-A1 | SELECTIVE LIGANDS OF RECEPTORS 5-HT 1D?-5HT 1B? DERIVED FROM INDOLE-PIPERAZINE USEFUL AS MEDICAMENTS | PIERRE FABRE MEDICAMENT (FR) | 1995-10-18 | — | — | EP | disclosed |
| WO-1994015916-A1 | SELECTIVE LIGANDS OF RECEPTORS 5-HT1D-5HT1B DERIVED FROM INDOLE-PIPERAZINE USEFUL AS MEDICAMENTS | PIERRE FABRE MEDICAMENT (FR) | 1994-07-21 | — | — | WO | disclosed |