⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4445189 | 0.67 | USP2 (0.54) | — | |
| SCHEMBL25600 | 0.67 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL63290 | 0.67 | — | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL16060132 | 0.67 | USP2 (1.00) | — | |
| Methanesulfonic Acid Methyl Ester SCHEMBL573583 | 0.67 | — | — | |
| SCHEMBL5553793 | 0.65 | ALDH1A1 (0.65) | — | |
| SCHEMBL5830076 | 0.65 | ALDH1A1 (0.65) | — | |
| SCHEMBL1414701 | 0.65 | — | — | |
| SCHEMBL5452053 | 0.64 | — | — | |
| SCHEMBL179013 | 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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2248806-A2 | Quinazoline derivatives as tyrosine kinase inhibitors | Shanghai Allist Pharmaceuticals, Inc. (CN) | 2010-11-10 | — | — | EP | claimed |
| EP-2850062-B1 | PYRIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CONDITIONS ASSOCIATED WITH PATHOLOGICAL THROMBUS FORMATION | SANOFI SA (FR) | 2017-07-19 | — | — | EP | disclosed |
| EP-2882715-B1 | PYRAZOLE DERIVATIVES AND THEIR USE AS LPAR5 ANTAGONISTS | SANOFI SA (FR) | 2016-11-09 | — | — | EP | disclosed |
| US-9346762-B2 | Pyrazole derivatives and their use as LPAR5 antagonists | SANOFI (FR) | 2016-05-24 | — | — | US | disclosed |
| US-9346757-B2 | Pyridine derivatives and their use in the treatment of conditions associated with pathological thrombus formation | SANOFI (FR) | 2016-05-24 | — | — | US | disclosed |
| US-20150141471-A1 | Pyridine Derivatives And Their Use In The Treatment Of Conditions Associated With Pathological Thrombus Formation | SANOFI (FR) | 2015-05-21 | — | — | US | disclosed |
| US-20150141477-A1 | Pyrazole Derivatives And Their Use As LPAR5 Antagonists | SANOFI (FR) | 2015-05-21 | — | — | US | disclosed |
| EP-2850062-A1 | PYRIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CONDITIONS ASSOCIATED WITH PATHOLOGICAL THROMBUS FORMATION | SANOFI (FR) | 2015-03-25 | — | — | EP | disclosed |
| WO-2013171316-A1 | PYRIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CONDITIONS ASSOCIATED WITH PATHOLOGICAL THROMBUS FORMATION | SANOFI (FR) | 2013-11-21 | — | — | WO | disclosed |