⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8746238 | 0.91 | — | — | |
| SCHEMBL24731769 | 0.85 | L3MBTL1 (0.31) | — | |
| SCHEMBL9441878 | 0.81 | CA1 (0.33) | — | |
| SCHEMBL6590053 | 0.79 | — | — | |
| SCHEMBL10251487 | 0.77 | — | — | |
| SCHEMBL11067015 | 0.76 | L3MBTL1 (0.35) | — | |
| SCHEMBL22868254 | 0.76 | — | — | |
| SCHEMBL6590775 | 0.76 | CA1 (0.41) | — | |
| SCHEMBL11067012 | 0.76 | L3MBTL1 (0.35) | — | |
| SCHEMBL11067021 | 0.76 | L3MBTL1 (0.35) | — |
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-3248999-B1 | NOVEL METHOD FOR PREPARING HIGHLY TRANSPARENT AND HIGHLY HEAT-RESISTANT POLYCARBONATE ESTER | SK CHEMICALS CO LTD (KR) | 2019-11-20 | — | — | EP | claimed |
| US-5189232-A | Reacting lower alkyl cyclopentanes and c5-c8 olefins in presence of sulfuric or hydrofluoric acid to produce high density, high heat of combustion and low freezing point hydrocarbons | UNIVERSITY OF UTAH (US) | 1993-02-23 | — | — | US | disclosed |
| US-4382851-A | HYDROGEN SULFIDE, CARBON MONOXIDE, AROMATIC HYDROCARBONS | MOBIL OIL CORPORATION (US) | 1983-05-10 | — | — | US | disclosed |