⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28924905 | 0.98 | CA12 (0.41) | — | |
| SCHEMBL7825058 | 0.93 | KDM5A (0.42) | — | |
| SCHEMBL6894680 | 0.91 | KDM5A (0.43) | — | |
| SCHEMBL23616238 | 0.84 | — | — | |
| SCHEMBL55496 | 0.77 | CA1 (0.56) | — | |
| SCHEMBL851935 | 0.77 | — | — | |
| SCHEMBL11277722 | 0.77 | — | — | |
| SCHEMBL20285412 | 0.77 | CA1 (0.44) | — | |
| SCHEMBL42636 | 0.77 | CA1 (0.56) | — | |
| SCHEMBL4894337 | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108368368-A | Water-based ink for use in ink-jet recording group and ink jet recording method | DIC株式会社 | 2018-08-03 | — | — | CN | disclosed |
| CN-107148456-A | Water-based ink for ink-jet recording | DIC株式会社 | 2017-09-08 | — | — | CN | disclosed |
| CN-105462362-A | Ink composition, method of producing ink composition, and image forming method | FUJIFILM CORP | 2016-04-06 | — | — | CN | disclosed |
| CN-1151125-C | Compounds and methods for treating cardiovascular, inflammatory and immune disorders | ǧ��ҩƷ��˾ | 2004-05-26 | — | — | CN | disclosed |
| CN-1163610-A | Compounds and methods for treating cardiovascular, inflammatory and immune disorders | CYTOMED INC (US) | 1997-10-29 | — | — | CN | disclosed |
| CN-1090284-A | The anti-inflammatory of dual-use function and immunosuppressor | CYTOMED INC (US) | 1994-08-03 | — | — | CN | disclosed |