⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL633078 | 0.78 | GBA1 (0.32) | — | |
| SCHEMBL7355166 | 0.77 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL2922550 | 0.76 | FAAH (0.34) | — | |
| SCHEMBL787106 | 0.76 | FAAH (0.34) | — | |
| SCHEMBL786721 | 0.76 | FAAH (0.34) | — | |
| Water SCHEMBL28388741 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL9000514 | 0.74 | CYP3A4 (0.37) | — | |
| SCHEMBL4658185 | 0.73 | ACE (0.37) | — | |
| SCHEMBL9485556 | 0.73 | PIK3CD (0.34) | — | |
| SCHEMBL8368471 | 0.73 | CHRNA7 (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6180123-B1 | FOR CARE AND/OR MAKE-UP OF SKIN, HUMAN FACE AND HUMAN BODY, MUCOUS MEMBRANES SUCH AS LIPS AND INSIDE OF LOWER EYELIDS, OR THE SUPERFICIAL BODY GROWTHS SUCH AS EYELASHES, EYEBROWS, NAILS AND HAIR | L'OREAL (FR) | 2001-01-30 | — | — | US | disclosed |