⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12151878 | 0.71 | — | — | |
| SCHEMBL6741401 | 0.69 | — | — | |
| SCHEMBL7475808 | 0.67 | — | — | |
| SCHEMBL1053912 | 0.66 | — | — | |
| SCHEMBL12018613 | 0.66 | — | — | |
| SCHEMBL9577028 | 0.65 | — | — | |
| SCHEMBL1055963 | 0.65 | — | — | |
| SCHEMBL8670208 | 0.65 | — | — | |
| SCHEMBL13205370 | 0.65 | — | — | |
| SCHEMBL6558286 | 0.65 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160088835-A1 | AGROCHEMICAL OIL DISPERSION FORMULATION, USE OF THE AGROCHEMICAL OIL DISPERSION FORMULATIONS AND PROCESS FOR THE PREPARATION OF THE AGROCHEMICAL OIL DISPERSION FORMULATION | OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) | 2016-03-31 | — | — | US | disclosed |
| EP-2987405-A1 | AGROCHEMICAL FORMULATION OF THE OIL DISPERSION TYPE, USE OF THE AGROCHEMICAL FORMULATIONS OF THE OIL DISPERSION TYPE, AND METHOD FOR PRODUCING AN AGROCHEMICAL FORMULATION OF THE OIL DISPERSION TYPE | Oxiteno S.A. Industria e Comercio (BR) | 2016-02-24 | — | — | EP | disclosed |
| CN-105338811-A | Agrochemical formulation of the oil dispersion type, use of the agrochemical formulations of the oil dispersion type, and method for producing an agrochemical formulation of the oil dispersion type | OXITENO SA IND E COMERCIO | 2016-02-17 | — | — | CN | disclosed |
| US-5770598-A | ANTITUMOR AGENTS; REACTING WITH CARBONYL DIIMIDAZOLE AND AMIDOXIMES | UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) | 1998-06-23 | — | — | US | disclosed |
| EP-0769012-A1 | TETRACYCLIC DERIVATIVES AND THEIR USE AS ANTITUMOUR AGENTS | THE WELLCOME FOUNDATION LIMITED (GB) | 1997-04-23 | — | — | EP | disclosed |
| WO-1996001827-A1 | TETRACYCLIC DERIVATIVES AND THEIR USE AS ANTITUMOUR AGENTS | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-01-25 | — | — | WO | disclosed |