⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7941755 | 0.83 | L3MBTL1 (0.31) | — | |
| SCHEMBL7933160 | 0.83 | L3MBTL1 (0.31) | — | |
| SCHEMBL3504643 | 0.83 | L3MBTL1 (0.31) | — | |
| SCHEMBL3662856 | 0.81 | — | — | |
| SCHEMBL7940678 | 0.80 | UGT2B7 (0.31) | — | |
| SCHEMBL11790624 | 0.80 | — | — | |
| SCHEMBL7933170 | 0.80 | UGT2B7 (0.31) | — | |
| Iodide SCHEMBL11791559 | 0.79 | — | — | |
| SCHEMBL3661078 | 0.79 | PTPN1 (0.37) | — | |
| SCHEMBL16037390 | 0.79 | — | — |
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-0315913-B1 | ANTISEBORRHOIC TOPICAL COMPOSITIONS | Henkel Kommanditgesellschaft auf Aktien (DE) | 1992-06-10 | — | — | EP | disclosed |
| US-4939171-A | Alkyl and alkenyl aryl ether derivatives; cosmetics | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1990-07-03 | — | — | US | disclosed |
| EP-0315913-A1 | Antiseborrhoic topical compositions | Henkel Kommanditgesellschaft auf Aktien (DE) | 1989-05-17 | — | — | EP | disclosed |