⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10514665 | 0.90 | — | — | |
| SCHEMBL10524008 | 0.83 | — | — | |
| SCHEMBL10515450 | 0.83 | — | — | |
| SCHEMBL10514687 | 0.81 | — | — | |
| SCHEMBL10516639 | 0.80 | HTR1A (0.68) | — | |
| SCHEMBL10514753 | 0.79 | — | — | |
| SCHEMBL10514130 | 0.79 | DRD2 (0.43) | — | |
| SCHEMBL10513738 | 0.79 | HTR1A (0.57) | — | |
| SCHEMBL4684354 | 0.78 | — | — | |
| SCHEMBL10514152 | 0.78 | HTR1A (0.56) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0190472-B1 | NEW PHARMACEUTICAL COMPOSITIONS HAVING ANTI-PSYCHOTIC PROPERTIES | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1989-07-12 | — | — | EP | claimed |
| EP-0190472-A1 | New pharmaceutical compositions having anti-psychotic properties | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1986-08-13 | — | — | EP | claimed |
| EP-0190472-B1 | NEW PHARMACEUTICAL COMPOSITIONS HAVING ANTI-PSYCHOTIC PROPERTIES | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1989-07-12 | — | — | EP | disclosed |
| US-4782061-A | CENTRAL NERVOUS SYSTEM DISORDERS | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1988-11-01 | — | — | US | disclosed |
| EP-0190472-A1 | New pharmaceutical compositions having anti-psychotic properties | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1986-08-13 | — | — | EP | disclosed |