⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL580283 | 0.73 | — | — | |
| SCHEMBL622233 | 0.73 | — | — | |
| SCHEMBL579439 | 0.73 | — | — | |
| SCHEMBL16112386 | 0.73 | — | — | |
| SCHEMBL502813 | 0.73 | — | — | |
| SCHEMBL527263 | 0.71 | — | — | |
| SCHEMBL1050727 | 0.71 | — | — | |
| SCHEMBL2914655 | 0.71 | — | — | |
| SCHEMBL7708613 | 0.71 | — | — | |
| SCHEMBL3385951 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017162900-A1 | METHOD FOR RECOVERING THE OXYGENATED COMPOUNDS CONTAINED IN AQUEOUS FRACTIONS DERIVED FROM BIOMASS | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) | 2017-09-28 | — | — | WO | disclosed |
| WO-2004019956-A1 | ORGANOPHOSPHOROUS COMPOUNDS FOR THE TREATMENT OF HELMINTHIC INFECTIONS | BIOAGENCY AG (DE) | 2004-03-11 | — | — | WO | disclosed |
| US-5714457-A | LOW IN IRRITATIVENESS TO SKIN AND HAIR, EXCELLENT IN FOAMABILITY | KAO CORPORATION (JP) | 1998-02-03 | — | — | US | disclosed |
| EP-0268553-B1 | PHOTOSENSITIVE MIXTURES | CIBA-GEIGY AG (CH) | 1991-09-11 | — | — | EP | disclosed |
| US-4835085-A | 1,2-Naphthoquinone diazide sulfonyl ester compound with linking benzotriazole groups and light-sensitive composition with compound | CIBA-GEIGY CORPORATION (US) | 1989-05-30 | — | — | US | disclosed |
| EP-0268553-A1 | Photosensitive mixtures | CIBA-GEIGY AG (CH) | 1988-05-25 | — | — | EP | disclosed |