⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2299297 | 0.67 | — | — | |
| SCHEMBL8516498 | 0.61 | — | — | |
| SCHEMBL3960685 | 0.61 | — | — | |
| SCHEMBL18281477 | 0.61 | — | — | |
| SCHEMBL3264915 | 0.61 | — | — | |
| SCHEMBL29016372 | 0.61 | — | — | |
| SCHEMBL13259285 | 0.61 | — | — | |
| Zinc Ion SCHEMBL11229022 | 0.59 | — | — | |
| SCHEMBL1071696 | 0.59 | — | — | |
| SCHEMBL102156 | 0.56 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012140254-A1 | RUBBER COMPOSITION COMPRISING A THIAZOLINE DERIVATIVE | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2012-10-18 | — | — | WO | disclosed |
| EP-2473049-A1 | BRUTON'S TYROSINE KINASE INHIBITORS | Biogen Idec MA Inc. (US) | 2012-07-11 | — | — | EP | disclosed |
| EP-2421871-A1 | THIA-TRIAZA-CYCLOPENTAZULENES AS PI3-KINASES INHIBITORS FOR THE TREATMENT OF CANCER | Boehringer Ingelheim International GmbH (DE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2011029046-A1 | BRUTON'S TYROSINE KINASE INHIBITORS | BIOGEN IDEC MA INC. (US) | 2011-03-10 | — | — | WO | disclosed |
| EP-2280982-A1 | THIAZOLYL-DIHYDRO-INDAZOLES | Boehringer Ingelheim International GmbH (DE) | 2011-02-09 | — | — | EP | disclosed |
| WO-2010122071-A1 | THIA-TRIAZA-CYCLOPENTAZULENES AS PI3-KINASES INHIBITORS FOR THE TREATMENT OF CANCER | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-10-28 | — | — | WO | disclosed |
| WO-2009112565-A1 | THIAZOLYL-DIHYDRO-INDAZOLES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-09-17 | — | — | WO | disclosed |
| EP-0863879-A1 | HERBICIDAL SUBSTITUTED PYRAZOLE COMPOUNDS | ZENECA LIMITED (GB) | 1998-09-16 | — | — | EP | disclosed |
| US-5786302-A | PREEMERGENCE, POSTEMERGENCE HERBICIDES | ZENECA LIMITED (GB) | 1998-07-28 | — | — | US | disclosed |
| US-5698495-A | Herbicidal substituted pyrazole compounds | ZENECA LIMITED (GB) | 1997-12-16 | — | — | US | disclosed |
| WO-1997018196-A1 | HERBICIDAL SUBSTITUTED PYRAZOLE COMPOUNDS | ZENECA LIMITED (GB) | 1997-05-22 | — | — | WO | disclosed |
| US-5192498-A | Reacting with calcium hypochlorite, sodium hypochlorite, chloramine T or chloramine B | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-03-09 | — | — | US | disclosed |
| EP-0280929-A1 | Mono- and diepoxide derivatives of 23-deoxy-LL-F28249 compounds | AMERICAN CYANAMID COMPANY (US) | 1988-09-07 | — | — | EP | disclosed |