⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2638447 | 1.00 | — | — | |
| SCHEMBL27507873 | 0.98 | EHMT2 (0.54) | — | |
| SCHEMBL28481761 | 0.83 | LMNA (0.42) | — | |
| SCHEMBL5020551 | 0.83 | ALDH1A1 (0.58) | — | |
| SCHEMBL28482507 | 0.82 | LMNA (0.41) | — | |
| SCHEMBL7205329 | 0.81 | EHMT2 (0.61) | — | |
| SCHEMBL422519 | 0.79 | ALDH1A1 (0.54) | — | |
| SCHEMBL327697 | 0.78 | EHMT2 (0.64) | — | |
| SCHEMBL2608954 | 0.78 | KMT2A (0.58) | — | |
| SCHEMBL433842 | 0.78 | EHMT2 (0.52) | — |
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-0707579-B1 | PIPERIDINYL SUBSTITUTED METHANOANTHRACENES AS D1/D2-ANTAGONISTS AND 5HT2-SEROTANIN-ANTAGONISTS | ZENECA LTD (GB) | 1999-01-20 | — | — | EP | disclosed |
| US-5681840-A | ANTIDOPAMINERGIC AGENTS | ZENECA LIMITED (GB) | 1997-10-28 | — | — | US | disclosed |
| US-5512575-A | ANTISEROTONINE AGENT | ZENECA LIMITED (GB) | 1996-04-30 | — | — | US | disclosed |
| EP-0707579-A1 | PIPERIDINYL SUBSTITUTED METHANOANTHRACENES AS D1/D2-ANTAGONISTS AND 5HT2-SEROTANIN-ANTAGONISTS | ZENECA LIMITED (GB) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995001974-A1 | PIPERIDINYL SUBSTITUTED METHANOANTHRACENES AS D1/D2-ANTAGONISTS AND 5HT2-SEROTANIN-ANTAGONISTS | ZENECA LIMITED (GB) | 1995-01-19 | — | — | WO | disclosed |