⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2315565 | 1.00 | MEN1 (0.67) | — | |
| Hydrochloric Acid SCHEMBL8503683 | 0.94 | — | — | |
| SCHEMBL11204366 | 0.94 | MEN1 (0.75) | — | |
| SCHEMBL3091709 | 0.94 | — | — | |
| SCHEMBL1238559 | 0.94 | MEN1 (0.75) | — | |
| Lithium Ion SCHEMBL6438414 | 0.88 | — | — | |
| SCHEMBL8581600 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL2535368 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL2535374 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL4304763 | 0.88 | MEN1 (0.67) | — |
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-20160226118-A1 | SODIUM-BASED HYBRID FLOW BATTERIES WITH ULTRAHIGH ENERGY DENSITIES | ILLINOIS INSTITUTE OF TECHNOLOGY | 2016-08-04 | — | — | US | claimed |
| US-5502089-A | UNSATURATED CARBOXYLIC ACID COPOLYMER LATEX | ROHM AND HAAS COMPANY (US) | 1996-03-26 | — | — | US | disclosed |