⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27486078 | 0.88 | — | — | |
| SCHEMBL27497198 | 0.79 | — | — | |
| SCHEMBL21651088 | 0.78 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL21651090 | 0.78 | GAA (0.31) | — | |
| SCHEMBL8351636 | 0.74 | — | — | |
| SCHEMBL27700628 | 0.74 | EPHX1 (0.30) | — | |
| SCHEMBL27700626 | 0.74 | EPHX1 (0.30) | — | |
| SCHEMBL27721337 | 0.74 | EPHX1 (0.30) | — | |
| SCHEMBL27721299 | 0.74 | EPHX1 (0.30) | — | |
| SCHEMBL27700621 | 0.74 | EPHX1 (0.30) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3516032-A1 | SUGAR AS AN ODORANT CARRIER MATERIAL | Henkel AG & Co. KGaA (DE) | 2019-07-31 | — | — | EP | disclosed |
| WO-2018055114-A1 | SUGAR AS AN ODORANT CARRIER MATERIAL | HENKEL AG & CO. KGAA (DE) | 2018-03-29 | — | — | WO | disclosed |
| CN-104379545-A | Method for producing 4,4''-dihydroxy-m-terphenyls | HONSHU CHEMICAL IND | 2015-02-25 | — | — | CN | disclosed |
| CN-104203887-A | Trisphenol production method | HONSHU CHEMICAL IND | 2014-12-10 | — | — | CN | disclosed |
| CN-104203889-A | Novel bis(4-hydroxyphenyl) cyclohexene | HONSHU CHEMICAL IND | 2014-12-10 | — | — | CN | disclosed |