⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1964015 | 0.79 | MMP1 (0.30) | — | |
| SCHEMBL271756 | 0.78 | — | — | |
| SCHEMBL1961332 | 0.78 | — | — | |
| SCHEMBL28032048 | 0.74 | — | — | |
| SCHEMBL271372 | 0.74 | — | — | |
| SCHEMBL27652156 | 0.74 | — | — | |
| SCHEMBL2702508 | 0.74 | — | — | |
| SCHEMBL105724 | 0.74 | — | — | |
| SCHEMBL6006390 | 0.74 | — | — | |
| SCHEMBL28031456 | 0.74 | — | — |
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
Appears in 2914 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11396502-B2 | Substituted heterocyclic derivatives as PI3K inhibitors | INCYTE CORPORATION (US) | 2022-07-26 | — | — | US | claimed |
| WO-2020102216-A1 | SUBSTITUTED HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION (US) | 2020-05-22 | — | — | WO | claimed |
| CN-111170988-A | Pyrazole formamide derivative containing substituted sulfimide acyl aryl, and preparation method and application thereof | 南开大学 | 2020-05-19 | — | — | CN | claimed |
| US-20200148667-A1 | SUBSTITUTED HETEROCYCLIC DERIVATIVES AS PI3K INHIBITORS | INCYTE CORPORATION | 2020-05-14 | — | — | US | claimed |
| EP-2187884-B1 | ISOTHIAZOLOPYRIDINONES USEFUL FOR THE TREATMENT OF (INTER ALIA) CYSTIC FIBROSIS | VERTEX PHARMA (US) | 2016-03-30 | — | — | EP | claimed |
| US-20150315186-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED | 2015-11-05 | — | — | US | claimed |
| US-9134329-B2 | Compositions and methods for drug-sensitization or inhibition of a cancer cell | THE TEXAS A&M UNIVERSITY SYSTEM (US) | 2015-09-15 | — | — | US | claimed |
| US-20150065487-A1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMA (US) | 2015-03-05 | — | — | US | claimed |
| US-20150031722-A1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED | 2015-01-29 | — | — | US | claimed |
| US-20140235668-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VPI | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-08-21 | — | — | US | claimed |
| EP-0560274-A1 | Antiherpes peptide derivatives having a ureido N-terminus | BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) | 1993-09-15 | — | — | EP | claimed |
| US-5114959-A | FUNGICIDAL SUBSTITUTED ACRYLIC ESTERS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-05-19 | — | — | US | claimed |
| EP-0173821-B1 | SUBSTITUTED 5-AMINO-1-PHENYL PYRAZOLES | BAYER AG (DE) | 1989-01-18 | — | — | EP | claimed |
| US-4740232-A | Substituted 5-amino-1-phenylpyrazoles composition containing them and herbicidal method of using them | BAYER AKTIENGESELLSCHAFT (DE) | 1988-04-26 | — | — | US | claimed |
| US-4685956-A | 1-aryl-5-hydrazino-pyrazoles, compositions containing them, and herbicidal method of using them | BAYER AKTIENGESELLSCHAFT (DE) | 1987-08-11 | — | — | US | claimed |
| EP-0212353-A2 | 1-Aryl-5-hydrazino-pyrazoles | BAYER AG (DE) | 1987-03-04 | — | — | EP | claimed |
| EP-0205021-A2 | 5-Amino-4-cyano-1-pyridyl pyrazoles | BAYER AG (DE) | 1986-12-17 | — | — | EP | claimed |
| EP-0173821-A1 | Substituted 5-amino-1-phenyl pyrazoles | BAYER AG (DE) | 1986-03-12 | — | — | EP | claimed |
| US-4268510-A | DEMETHANIZATION, METABOLISM, RUMEN | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1981-05-19 | — | — | US | claimed |
| EP-0010348-A1 | Heterocyclic trichloromethyl derivatives, process for their preparation and their use | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-04-30 | — | — | EP | claimed |