⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12004025 | 1.00 | — | — | |
| SCHEMBL7716429 | 0.71 | — | — | |
| SCHEMBL6434956 | 0.67 | — | — | |
| SCHEMBL12186004 | 0.67 | — | — | |
| SCHEMBL1741946 | 0.67 | — | — | |
| SCHEMBL327251 | 0.64 | — | — | |
| SCHEMBL6973512 | 0.64 | — | — | |
| SCHEMBL7401940 | 0.64 | — | — | |
| SCHEMBL9705879 | 0.64 | — | — | |
| SCHEMBL9705883 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110023410-A | Composition, fiber treatment agent, fiber treatment method and treated fiber | 信越化学工业株式会社 | 2019-07-16 | — | — | CN | disclosed |
| CN-108348484-A | Cationic steroidal antimicrobial salt | 布莱阿姆青年大学 | 2018-07-31 | — | — | CN | disclosed |
| CN-108135909-A | Cationic steroidal Antimicrobe compound and the method for preparing such compound | 布莱阿姆青年大学 | 2018-06-08 | — | — | CN | disclosed |
| CN-107629660-A | The preparation method of containing hydrogen silicone oil modified polyurethane paint | 国网江苏省电力公司南通供电公司 | 2018-01-26 | — | — | CN | disclosed |
| CN-107558238-A | Include the emulsion compositions containing aminoalkyl and the siloxanes of polyoxyalkylene | 信越化学工业株式会社 | 2018-01-09 | — | — | CN | disclosed |
| CN-101679308-B | Inhibitors of the hedgehog pathway | EXELIXIS INC | 2014-05-07 | — | — | CN | disclosed |
| US-8455500-B2 | 3-hydroxy-5-arylisoxazole derivative | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2013-06-04 | — | — | US | disclosed |
| EP-2495238-A1 | NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE | Mochida Pharmaceutical Co., Ltd. (JP) | 2012-09-05 | — | — | EP | disclosed |
| US-20120220772-A1 | NOVEL 3-HYDROXY-5-ARYLISOXAZOLE DERIVATIVE | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2012-08-30 | — | — | US | disclosed |
| CN-101679308-A | inhibitors of the hedgehog pathway | EXELIXIS INC | 2010-03-24 | — | — | CN | disclosed |
| WO-2000023444-A1 | 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS | ABBOTT LABORATORIES (US) | 2000-04-27 | — | — | WO | disclosed |