⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL118251 | 0.91 | — | — | |
| SCHEMBL27654068 | 0.89 | — | — | |
| SCHEMBL19667230 | 0.83 | — | — | |
| SCHEMBL27917432 | 0.79 | LMNA (0.30) | — | |
| SCHEMBL19667324 | 0.79 | — | — | |
| SCHEMBL19921 | 0.72 | — | — | |
| SCHEMBL29277835 | 0.71 | CYP3A4 (0.32) | — | |
| SCHEMBL27592615 | 0.70 | — | — | |
| SCHEMBL27513290 | 0.70 | — | — | |
| SCHEMBL27638868 | 0.70 | ACHE (0.36) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109476639-A | Pyrrolidin derivatives | 橘生药品工业股份有限公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-105143200-B | Serine/threonine kinase inhibitor for treating excess proliferative disease | 阵列生物制药公司 | 2018-10-16 | — | — | CN | disclosed |
| CN-108003155-A | 3,4 dihydro -1H [1,8] naphthyridones of the homopiperidinyl substitution of antibacterial | 爱尔兰詹森科学公司 | 2018-05-08 | — | — | CN | disclosed |
| CN-104781250-B | New antibacterial compounds | 爱尔兰詹森科学公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-104755475-B | Hiv protease inhibitor | 默沙东公司 | 2016-12-28 | — | — | CN | disclosed |
| CN-104507926-B | Serine/threonine kinase inhibitors | 阵列生物制药公司 | 2016-08-31 | — | — | CN | disclosed |
| CN-105143200-A | Serine/threonine kinase inhibitors for the treatment of hyperproliferative|diseases | ARRAY BIOPHARMA INC | 2015-12-09 | — | — | CN | disclosed |
| CN-104755475-A | Hiv protease inhibitors | MERCK SHARP & DOHME | 2015-07-01 | — | — | CN | disclosed |
| CN-104507926-A | Serine/threonine kinase inhibitors | ARRAY BIOPHARMA INC | 2015-04-08 | — | — | CN | disclosed |