⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27474942 | 0.79 | — | — | |
| SCHEMBL3728108 | 0.78 | CYP4F2 (0.32) | — | |
| SCHEMBL27549831 | 0.78 | TSHR (0.31) | — | |
| SCHEMBL28318306 | 0.78 | TSHR (0.31) | — | |
| SCHEMBL6553348 | 0.77 | — | — | |
| SCHEMBL3193373 | 0.76 | ALDH1A1 (0.30) | — | |
| SCHEMBL11208888 | 0.76 | — | — | |
| SCHEMBL17111395 | 0.73 | — | — | |
| SCHEMBL342673 | 0.72 | — | — | |
| SCHEMBL14563410 | 0.68 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1781239-A2 | COMPOSITIONS EFFECTIVE IN ALTERING THE PERCEPTION OF MALODOR | Patus Ltd (IL) | 2007-05-09 | — | — | EP | disclosed |
| WO-2005046632-A9 | COMPOSITIONS EFFECTIVE IN ALTERING THE PERCEPTION OF MALODOR | PATUS LTD (IL) | 2005-09-22 | — | — | WO | disclosed |
| WO-2005046632-A2 | COMPOSITIONS EFFECTIVE IN ALTERING THE PERCEPTION OF MALODOR | PATUS LTD. (IL) | 2005-05-26 | — | — | WO | disclosed |