⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24966533 | 0.76 | — | — | |
| SCHEMBL7922814 | 0.76 | — | — | |
| SCHEMBL321045 | 0.73 | — | — | |
| SCHEMBL23419947 | 0.69 | — | — | |
| SCHEMBL28448217 | 0.69 | — | — | |
| SCHEMBL1930705 | 0.67 | — | — | |
| SCHEMBL18198961 | 0.65 | — | — | |
| SCHEMBL17850110 | 0.65 | — | — | |
| SCHEMBL11068390 | 0.65 | — | — | |
| SCHEMBL19157312 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230108403-A1 | COMPOSITIONS AND SYSTEMS FOR DISINFECTION | Markesbery Blue Pearl LLC | 2023-04-06 | — | — | US | disclosed |
| CN-110283078-A | Polysubstituted 1, 4-diene compound and preparation method thereof | 南京工业大学 | 2019-09-27 | — | — | CN | disclosed |
| US-20170200899-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-07-13 | — | — | US | disclosed |
| US-9115301-B2 | Lubricating oil composition for chiller | IDEMITSU KOSAN CO., LTD. (JP) | 2015-08-25 | — | — | US | disclosed |
| EP-2551333-A1 | LUBRICATING OIL COMPOSITION FOR CHILLER | Idemitsu Kosan Co., Ltd. (JP) | 2013-01-30 | — | — | EP | disclosed |
| US-20130012419-A1 | LUBRICATING OIL COMPOSITION FOR CHILLER | IDEMITSU KOSAN CO., LTD. (JP) | 2013-01-10 | — | — | US | disclosed |