⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3094844 | 0.87 | — | — | |
| Isobutane SCHEMBL4756202 | 0.76 | ALDH1A1 (0.33) | — | |
| Isobutane SCHEMBL1691786 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL392896 | 0.76 | — | — | |
| Isobutane SCHEMBL23014455 | 0.72 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL164023 | 0.72 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL4756106 | 0.72 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL5164604 | 0.72 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL10580547 | 0.72 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL23014394 | 0.72 | ALDH1A1 (0.31) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1780257-B1 | USE OF LUBRICANT COMPOSITIONS | IDEMITSU KOSAN CO (JP) | 2018-06-13 | — | — | EP | disclosed |
| CN-105111636-A | Oil-resistant aging-resistant modified tetrafluoroethylene propylene rubber material | FANCHANG FEIDE COMM MATERIAL DESIGN CO LTD | 2015-12-02 | — | — | CN | disclosed |
| US-7803745-B2 | Lubricant composition | IDEMITSU KOSAN CO., LTD. (JP) | 2010-09-28 | — | — | US | disclosed |
| US-20080096775-A1 | Lubricant Composition | IDEMITSU KOSAN CO., LTD. (JP) | 2008-04-24 | — | — | US | disclosed |
| EP-1780257-A1 | LUBRICANT COMPOSITION | IDEMITSU KOSAN CO., LTD. (JP) | 2007-05-02 | — | — | EP | disclosed |
| CN-1336939-A | Tack-free surface curing of polymers by organic peroxides in the presence of air | ATOFINA CHEM INC (US) | 2002-02-20 | — | — | CN | disclosed |