⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11008374 | 1.00 | — | — | |
| SCHEMBL10906003 | 1.00 | — | — | |
| SCHEMBL8428628 | 0.94 | — | — | |
| SCHEMBL58775 | 0.94 | — | — | |
| SCHEMBL8647981 | 0.89 | — | — | |
| SCHEMBL11550340 | 0.89 | — | — | |
| SCHEMBL11698234 | 0.89 | — | — | |
| SCHEMBL11053283 | 0.89 | — | — | |
| SCHEMBL11553725 | 0.89 | — | — | |
| SCHEMBL10953294 | 0.89 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111793065-B | Spirocyclic aromatic organic conjugated micromolecular thermoelectric material and preparation and application thereof | 深圳大学 | 2021-10-15 | — | — | CN | claimed |
| CN-111793065-A | Spirocyclic aromatic organic conjugated micromolecular thermoelectric material and preparation and application thereof | 深圳大学 | 2020-10-20 | — | — | CN | claimed |
| CN-117946151-A | Silicon-containing high-etching-resistance molecular glass photoresist compound and preparation method and application thereof | 中国科学院化学研究所 | 2024-04-30 | — | — | CN | disclosed |
| CN-111793065-B | Spirocyclic aromatic organic conjugated micromolecular thermoelectric material and preparation and application thereof | 深圳大学 | 2021-10-15 | — | — | CN | disclosed |
| CN-110003179-B | Material with cross-shaped structural feature and preparation method and application thereof | 山东师范大学 | 2021-01-08 | — | — | CN | disclosed |
| CN-111793065-A | Spirocyclic aromatic organic conjugated micromolecular thermoelectric material and preparation and application thereof | 深圳大学 | 2020-10-20 | — | — | CN | disclosed |
| EP-1628957-B1 | SULFOPYRROLES | TAKEDA PHARMACEUTICAL (JP) | 2010-09-29 | — | — | EP | disclosed |
| US-7612064-B2 | Sulfopyrroles | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-11-03 | — | — | US | disclosed |
| US-20070060570-A1 | Sulfopyrroles | TALEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-03-15 | — | — | US | disclosed |
| EP-1655284-A1 | 2-Phenylsulfopyrroles | Aponetics AG (CH) | 2006-05-10 | — | — | EP | disclosed |
| EP-1644338-A1 | 2, 4, 6-TRISUBSTITUTED PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND AUTOIMMUNE DISEASES | Aponetics AG (CH) | 2006-04-12 | — | — | EP | disclosed |
| EP-1628957-A1 | SULFOPYRROLES | Takeda Pharmaceutical Company Limited (JP) | 2006-03-01 | — | — | EP | disclosed |
| WO-2004103968-A1 | SULFOPYRROLES | APONETICS AG (CH) | 2004-12-02 | — | — | WO | disclosed |
| WO-2004087679-A1 | 2, 4, 6-TRISUBSTITUTED PYRIMIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND AUTOIMMUNE DISEASES | APONETICS AG (CH) | 2004-10-14 | — | — | WO | disclosed |
| EP-0411410-B1 | PROCESS FOR THE PREPARATION OF OCTADIENOLS | BASF Aktiengesellschaft (DE) | 1993-06-30 | — | — | EP | disclosed |
| EP-0411410-A2 | Process for the preparation of octadienols | BASF Aktiengesellschaft (DE) | 1991-02-06 | — | — | EP | disclosed |
| US-4557809-A | Electrochemical synthesis of zerovalent transition metal organophosphorus complexes | BORG-WARNER CHEMICALS, INC. (US) | 1985-12-10 | — | — | US | disclosed |
| US-3992456-A | BY REACTING BUTADIENE WITH WATER IN THE PRESENCE OF A PALLADIUM CATALYST | UNION CARBIDE CORPORATION (US) | 1976-11-16 | — | — | US | disclosed |
| US-3970592-A | 2,7-DIMETHYL-1,4,6-OCTATRIENE, PERFUME | GIVAUDAN CORPORATION (US) | 1976-07-20 | — | — | US | disclosed |