⚠ 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 | |
|---|---|---|---|---|
| Oxirane SCHEMBL654963 | 0.84 | — | — | |
| Oxirane SCHEMBL1330900 | 0.84 | — | — | |
| Oxirane SCHEMBL3587 | 0.84 | — | — | |
| Oxirane SCHEMBL11492072 | 0.84 | — | — | |
| Oxirane SCHEMBL973217 | 0.84 | — | — | |
| Oxirane SCHEMBL886925 | 0.84 | — | — | |
| Oxirane SCHEMBL8094696 | 0.84 | TTR (0.83) | — | |
| Ethyne SCHEMBL2787823 | 0.84 | — | — | |
| Oxirane SCHEMBL28202102 | 0.80 | — | — | |
| Oxirane SCHEMBL11220618 | 0.77 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105745286-B | Ink-jet record aqueous pigment dispersions | 花王株式会社 | 2019-08-09 | — | — | CN | disclosed |
| CN-105612226-B | Aqueous pigment dispersions and water-based ink for use in ink-jet recording | DIC株式会社 | 2018-11-23 | — | — | CN | disclosed |
| CN-105593257-B | Aqueous pigment dispersion, pigment dispersant, and core-shell polymer particle | DIC株式会社 | 2018-09-25 | — | — | CN | disclosed |
| CN-108299168-A | A kind of preparation method of novel polysubstituted α-allene aldehyde and α-allene Carbonyl compounds | 兰州大学 | 2018-07-20 | — | — | CN | disclosed |
| CN-100562546-C | pigment-dispersed aqueous recording liquid and printed matter | SEIKO EPSON CORP MITSUBISHI CH (JP) | 2009-11-25 | — | — | CN | disclosed |
| US-7270699-B2 | Ink set for ink-jet recording, ink-jet recording method and ink-jet recording apparatus | FUJI XEROX CO., LTD. (JP) | 2007-09-18 | — | — | US | disclosed |
| US-20050166792-A1 | Ink set for ink-jet recording, ink-jet recording method and ink-jet recording apparatus | FUJI XEROX CO., LTD. (JP) | 2005-08-04 | — | — | US | disclosed |
| CN-1526776-A | pigment-dispersed aqueous recording liquid and printed matter | ������������ʽ���� | 2004-09-08 | — | — | CN | disclosed |