⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15810525 | 0.79 | TDP1 (0.44) | — | |
| SCHEMBL14534162 | 0.79 | KDM4E (0.39) | — | |
| SCHEMBL41139 | 0.78 | APOBEC3G (0.60) | — | |
| SCHEMBL29366632 | 0.78 | APOBEC3G (0.60) | — | |
| SCHEMBL21655415 | 0.77 | TAAR1 (0.35) | — | |
| SCHEMBL23513636 | 0.75 | PDCD1 (0.53) | — | |
| SCHEMBL12667816 | 0.75 | APOBEC3G (0.37) | — | |
| SCHEMBL24801293 | 0.75 | APOBEC3G (0.37) | — | |
| SCHEMBL10062411 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28375849 | 0.73 | APOBEC3G (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021252555-A1 | COLLAGEN 1 TRANSLATION INHIBITORS AND METHODS OF USE THEREOF | ANIMA BIOTECH INC. (US) | 2021-12-16 | — | — | WO | disclosed |
| CN-107872956-B | Synergistic antifungal composition containing benzoxaborole | 宾夕法尼亚州研究基金会 | 2020-07-10 | — | — | CN | disclosed |
| WO-2017012559-A1 | FUSED RING PYRIMIDINE COMPOUND, INTERMEDIATE, AND PREPARATION METHOD, COMPOSITION AND USE THEREOF | 广州再极医药科技有限公司 | 2017-01-26 | — | — | WO | disclosed |
| WO-2014089904-A1 | TRIAZINONE COMPOUNDS | ABBVIE INC. (US) | 2014-06-19 | — | — | WO | disclosed |
| EP-2368891-B1 | Pyrimidines derivatives as antagonists of the vitronectine receptors | GALAPAGOS NV (BE) | 2012-09-19 | — | — | EP | disclosed |
| EP-2368891-A1 | Pyrimidines derivatives as antagonists of the vitronectine receptors | Galapagos SAS (FR) | 2011-09-28 | — | — | EP | disclosed |