⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10818774 | 0.85 | ACHE (0.41) | — | |
| Hydrochloric Acid SCHEMBL15512214 | 0.83 | ACHE (0.40) | — | |
| SCHEMBL10620641 | 0.79 | — | — | |
| SCHEMBL7512600 | 0.79 | — | — | |
| SCHEMBL16893305 | 0.79 | ACHE (0.38) | — | |
| SCHEMBL6443493 | 0.77 | — | — | |
| SCHEMBL18623993 | 0.77 | — | — | |
| SCHEMBL31494978 | 0.77 | — | — | |
| SCHEMBL22431776 | 0.76 | KDM4E (0.48) | — | |
| SCHEMBL1007134 | 0.75 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0399899-B1 | Process for the preparation of aromatic ethers | RHONE POULENC SANTE (FR) | 1994-04-13 | — | — | EP | claimed |
| US-4649160-A | HYPOTENSIVE, ANTIARRHYTHMIA, ADRENERGIC BLOCKING AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1987-03-10 | — | — | US | claimed |
| EP-0041233-B1 | SUBSTITUTED PHENOXY-AMINOPROPANOL DERIVATIVES, INTERMEDIATES AND PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-02-15 | — | — | EP | claimed |
| US-4011321-A | 6-(3-SUBSTITUTED AMINO-2-HYDROXYPROPOXYARYL)-4,5-DIHYDRO-3(2H)-PYRIDAZINONES | SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) | 1977-03-08 | — | — | US | claimed |
| JP-57016861-A | — | — | None | — | — | JP | disclosed |
| US-5013855-A | Process for the preparation of aromatic ethers | RHONE-POULENC SANTE (FR) | 1991-05-07 | — | — | US | disclosed |
| EP-0120558-B1 | ANTIHYPERTENSIVE N-PIPERAZINYLALKANOYLANILIDES | RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) | 1989-03-08 | — | — | EP | disclosed |
| US-4649160-A | HYPOTENSIVE, ANTIARRHYTHMIA, ADRENERGIC BLOCKING AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1987-03-10 | — | — | US | disclosed |
| US-4340595-A | ADRENERGIC BLOCKING AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 1982-07-20 | — | — | US | disclosed |
| JP-S5716861-A | PREPARATION OF 4-(3-ALKYLAMINO-2-HYDROXYPROPOXY)-INDOLE | DAI ICHI PURE CHEM CO LTD | 1982-01-28 | — | — | JP | disclosed |
| US-4082843-A | 3-(3-(3-Substituted amino-2-hydroxypropoxy)phenyl)-6-hydrazino pyridazines and their use as vasodilators and β-adrenergic blocking agents | SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) | 1978-04-04 | — | — | US | disclosed |
| US-4011321-A | 6-(3-SUBSTITUTED AMINO-2-HYDROXYPROPOXYARYL)-4,5-DIHYDRO-3(2H)-PYRIDAZINONES | SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) | 1977-03-08 | — | — | US | disclosed |