⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11238641 | 0.75 | EPHX2 (0.41) | — | |
| SCHEMBL25334438 | 0.75 | — | — | |
| SCHEMBL1760686 | 0.73 | — | — | |
| SCHEMBL597700 | 0.73 | — | — | |
| SCHEMBL598153 | 0.73 | — | — | |
| SCHEMBL599491 | 0.73 | — | — | |
| SCHEMBL8378343 | 0.73 | — | — | |
| SCHEMBL27605829 | 0.73 | NOS3 (0.31) | — | |
| SCHEMBL11670109 | 0.72 | — | — | |
| SCHEMBL11250071 | 0.70 | ALOX5 (0.36) | — |
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-0361347-B1 | LUBRICATING OIL FOR TRACTION DRIVES | Mitsubishi Oil Company, Limited (JP) | 1991-09-25 | — | — | EP | disclosed |
| US-5043497-A | Methyl substituted dicyclohexylmethane compounds | MITSUBISHI OIL CO., LTD. (JP) | 1991-08-27 | — | — | US | disclosed |
| EP-0361347-A1 | Lubricating oil for traction drives | Mitsubishi Oil Company, Limited (JP) | 1990-04-04 | — | — | EP | disclosed |