⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17419871 | 0.86 | — | — | |
| SCHEMBL17419523 | 0.82 | — | — | |
| SCHEMBL11625099 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL3154825 | 0.68 | DUSP3 (0.34) | — | |
| SCHEMBL17419676 | 0.68 | — | — | |
| SCHEMBL17231977 | 0.67 | — | — | |
| SCHEMBL3162802 | 0.67 | — | — | |
| SCHEMBL17419561 | 0.65 | ALDH1A1 (0.34) | — | |
| SCHEMBL3154372 | 0.65 | L3MBTL1 (0.36) | — | |
| SCHEMBL17419501 | 0.65 | ESR1 (0.30) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10299476-B2 | 3′-substituted-abscisic acid derivatives | VALENT BIOSCIENCES LLC (US) | 2019-05-28 | — | — | US | disclosed |
| US-10299476-B2 | 3′-substituted-abscisic acid derivatives | VALENT BIOSCIENCES LLC (US) | 2019-05-28 | — | — | US | disclosed |
| US-20170360037-A1 | 3′-SUBSTITUTED-ABSCISIC ACID DERIVATIVES | VALENT BIOSCIENCES LLC (US) | 2017-12-21 | — | — | US | disclosed |
| US-20170360037-A1 | 3′-SUBSTITUTED-ABSCISIC ACID DERIVATIVES | VALENT BIOSCIENCES LLC (US) | 2017-12-21 | — | — | US | disclosed |
| US-20170360037-A1 | 3′-SUBSTITUTED-ABSCISIC ACID DERIVATIVES | VALENT BIOSCIENCES LLC (US) | 2017-12-21 | — | — | US | disclosed |
| US-9781930-B2 | 3′-substituted-abscisic acid derivatives | VALENT BIOSCIENCES LLC (US) | 2017-10-10 | — | — | US | disclosed |
| US-9781930-B2 | 3′-substituted-abscisic acid derivatives | VALENT BIOSCIENCES LLC (US) | 2017-10-10 | — | — | US | disclosed |
| US-9781930-B2 | 3′-substituted-abscisic acid derivatives | VALENT BIOSCIENCES LLC (US) | 2017-10-10 | — | — | US | disclosed |
| US-20160007598-A1 | 3'-SUBSTITUTED-ABSCISIC ACID DERIVATIVES | VALENT BIOSCIENCES CORPORATION | 2016-01-14 | — | — | US | disclosed |
| US-20160007598-A1 | 3'-SUBSTITUTED-ABSCISIC ACID DERIVATIVES | VALENT BIOSCIENCES CORPORATION | 2016-01-14 | — | — | US | disclosed |
| US-20160007598-A1 | 3'-SUBSTITUTED-ABSCISIC ACID DERIVATIVES | VALENT BIOSCIENCES CORPORATION | 2016-01-14 | — | — | US | disclosed |