⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14536617 | 0.72 | CA12 (0.31) | — | |
| SCHEMBL10944528 | 0.70 | KDM4E (0.37) | — | |
| SCHEMBL12967499 | 0.70 | MPO (0.31) | — | |
| SCHEMBL22761604 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL431523 | 0.64 | TSHR (0.33) | — | |
| SCHEMBL283619 | 0.64 | TSHR (0.33) | — | |
| SCHEMBL15384960 | 0.64 | MEN1 (0.35) | — | |
| SCHEMBL92928 | 0.63 | — | — | |
| SCHEMBL7127686 | 0.63 | CHRM2 (0.30) | — | |
| SCHEMBL1484545 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120135904-A1 | LUBRICANT COMPOSITION | IDEMITSU KOSAN CO., LTD. (JP) | 2012-05-31 | — | — | US | disclosed |
| EP-2444474-A1 | LUBRICANT COMPOSITION | Idemitsu Kosan Co., Ltd. (JP) | 2012-04-25 | — | — | EP | disclosed |