⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7598644 | 1.00 | — | — | |
| SCHEMBL11366383 | 0.87 | HCAR2 (0.52) | — | |
| SCHEMBL11361211 | 0.87 | HCAR2 (0.52) | — | |
| SCHEMBL13282549 | 0.80 | — | — | |
| SCHEMBL690460 | 0.80 | — | — | |
| SCHEMBL690461 | 0.80 | — | — | |
| SCHEMBL5826328 | 0.80 | — | — | |
| SCHEMBL22092240 | 0.78 | HCAR2 (0.48) | — | |
| SCHEMBL4866847 | 0.78 | — | — | |
| SCHEMBL4866839 | 0.78 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107056611-B | Reactive plasticizer of polyester compound, preparation method and application thereof | 华中科技大学 | 2020-05-19 | — | — | CN | disclosed |
| CN-102907270-B | Method for increasing contents of fragrance and calcium in pear fruit | UNIV NANJING AGRICULTURAL | 2013-12-11 | — | — | CN | disclosed |
| CN-102907270-A | Method for increasing contents of fragrance and calcium in pear fruit | UNIV NANJING AGRICULTURAL | 2013-02-06 | — | — | CN | disclosed |
| EP-0816298-B1 | Agents for and method of reducing the fluidity drop of hydraulic cement compositions and method of producing such agents | TAKEMOTO OIL & FAT CO LTD (JP) | 2002-10-02 | — | — | EP | disclosed |
| US-5919881-A | USING WATER SOLUBLE VINYL COPOLYMER | TAKEMOTO YUSHI KABUSHIKI KAISHA (JP) | 1999-07-06 | — | — | US | disclosed |
| EP-0816298-A1 | Agents for and method of reducing the fluidity drop of hydraulic cement compositions and method of producing such agents | Takemoto Yushi Kabushiki Kaisha (JP) | 1998-01-07 | — | — | EP | disclosed |