⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13684596 | 0.87 | — | — | |
| SCHEMBL1584634 | 0.85 | — | — | |
| SCHEMBL27094638 | 0.83 | TSHR (0.32) | — | |
| SCHEMBL19361541 | 0.81 | — | — | |
| SCHEMBL28666266 | 0.81 | — | — | |
| SCHEMBL10923718 | 0.79 | MEN1 (0.43) | — | |
| SCHEMBL14088060 | 0.79 | TSHR (0.44) | — | |
| SCHEMBL10043022 | 0.79 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL9816947 | 0.79 | MAPT (0.34) | — | |
| SCHEMBL14088063 | 0.79 | TSHR (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110015395-A1 | PYRAZOLE COMPOUNDS WITH INHIBITORY ACTIVITY AGAINST ROS KINASE | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2011-01-20 | — | — | US | claimed |
| US-20170335031-A1 | POLYMERS FROM MUCONIC ACID ISOMERS AND ITS DERIVATIVES | PTT GLOBAL CHEMICAL PUBLIC COMPANY LIMITED (TH) | 2017-11-23 | — | — | US | disclosed |
| US-8273880-B2 | Pyrazole compounds with inhibitory activity against ROS kinase | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2012-09-25 | — | — | US | disclosed |
| US-20110015395-A1 | PYRAZOLE COMPOUNDS WITH INHIBITORY ACTIVITY AGAINST ROS KINASE | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2011-01-20 | — | — | US | disclosed |
| EP-0410659-A2 | Method and composition to impart improved conditioning properties to the hair | HELENE CURTIS, INC. (US) | 1991-01-30 | — | — | EP | disclosed |
| EP-0042626-B1 | ANTICONVULSIVE COMPOSITIONS | NEW YORK UNIVERSITY (US) | 1986-05-21 | — | — | EP | disclosed |
| US-4372974-A | Anticonvulsive compositions and method of treating convulsive disorders | NEW YORK UNIVERSITY (US) | 1983-02-08 | — | — | US | disclosed |
| US-4322440-A | Anticonvulsive compositions and method of treating convulsive disorders | NEW YORK UNIVERSITY (US) | 1982-03-30 | — | — | US | disclosed |
| EP-0042626-A2 | Anticonvulsive compositions | NEW YORK UNIVERSITY (US) | 1981-12-30 | — | — | EP | disclosed |