⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8511160 | 0.78 | CES2 (0.39) | — | |
| Chloromethane SCHEMBL5491655 | 0.77 | KDM6B (0.34) | — | |
| SCHEMBL220872 | 0.76 | KDM6B (0.37) | — | |
| Chloromethane SCHEMBL28035194 | 0.75 | KDM6B (0.33) | — | |
| SCHEMBL515925 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL28192366 | 0.74 | KDM6B (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL28121422 | 0.74 | KDM6B (0.35) | — | |
| SCHEMBL1923846 | 0.71 | ALDH1A1 (0.37) | — | |
| SCHEMBL1812399 | 0.71 | DGAT1 (0.33) | — | |
| SCHEMBL2491679 | 0.71 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8789937-B2 | Ink jet recording method and liquid dispersant | RICOH COMPANY, LTD. (JP) | 2014-07-29 | — | — | US | disclosed |
| US-8752947-B2 | Ink jet recording method and liquid dispersant | RICOH COMPANY, LTD. (JP) | 2014-06-17 | — | — | US | disclosed |
| US-20120133702-A1 | INK JET RECORDING METHOD AND LIQUID DISPERSANT | RICOH COMPANY, LTD. (JP) | 2012-05-31 | — | — | US | disclosed |
| US-20120133703-A1 | INK JET RECORDING METHOD AND LIQUID DISPERSANT | RICOH COMPANY, LTD. (JP) | 2012-05-31 | — | — | US | disclosed |
| US-4177179-A | ACRYLIC COPOLYMER AND EPOXY COMPOUND | TOYO SODA MANUFACTURING CO., LTD. (JP) | 1979-12-04 | — | — | US | disclosed |