⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4956376 | 0.90 | MEN1 (0.34) | — | |
| SCHEMBL4954912 | 0.90 | MEN1 (0.34) | — | |
| SCHEMBL7695983 | 0.86 | — | — | |
| Di(Hydroxyethyl)Ether SCHEMBL5922803 | 0.83 | TSHR (0.33) | — | |
| Ethylene Glycol SCHEMBL5922937 | 0.81 | ALDH1A1 (0.31) | — | |
| Triethylene Glycol SCHEMBL5922883 | 0.81 | MEN1 (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL7713247 | 0.78 | ALDH1A1 (0.38) | — | |
| SCHEMBL6466036 | 0.77 | — | — | |
| SCHEMBL3402458 | 0.77 | TDP1 (0.35) | — | |
| SCHEMBL26629 | 0.77 | TDP1 (0.35) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080206647-A1 | Ethylene oxide copolymer, polymer composition, and lithium secondary battery | NIPPON SHOKUBAI CO., LTD. | 2008-08-28 | — | — | US | disclosed |
| US-20060264601-A1 | Method for production of alkylene oxide based polymer | NIPPON SHOKUBAI CO., LTD. (JP) | 2006-11-23 | — | — | US | disclosed |
| US-20050245410-A1 | Water soluble nonionic alkylene oxide resin, and production process therefor | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 2005-11-03 | — | — | US | disclosed |
| EP-1568728-A2 | Water soluble non-ionic alkylene oxide resin and production process therefor | Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) | 2005-08-31 | — | — | EP | disclosed |
| US-4304883-A | DICYCLOPENTADIENE-MODIFIED ALKYD RESIN, UNSATURATED MONOEPOXIDE | HITACHI CHEMICAL COMPANY, LTD. (JP) | 1981-12-08 | — | — | US | disclosed |