⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL88777 | 0.73 | CYP2C19 (0.34) | — | |
| SCHEMBL1115344 | 0.73 | CHRM1 (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL7197485 | 0.72 | CYP2C19 (0.33) | — | |
| SCHEMBL7968681 | 0.72 | CYP2C19 (0.33) | — | |
| SCHEMBL9940179 | 0.72 | CYP2C19 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL7197487 | 0.72 | CYP2C19 (0.33) | — | |
| SCHEMBL131348 | 0.72 | CYP2C19 (0.33) | — | |
| SCHEMBL1115579 | 0.71 | HSPD1 (0.38) | — | |
| SCHEMBL3662936 | 0.69 | HSPD1 (0.46) | — | |
| SCHEMBL5562100 | 0.69 | HSPD1 (0.46) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230094605-A1 | RESIN EMULSION FOR WATER-BASED INK | NIPPON SHOKUBAI CO., LTD. (JP) | 2023-03-30 | — | — | US | disclosed |
| CN-115003765-A | Ink for ink jet | 株式会社日本触媒 | 2022-09-02 | — | — | CN | disclosed |
| CN-113365831-A | Emulsion for aqueous ink, and ink composition for aqueous ink containing same | 株式会社日本触媒 | 2021-09-07 | — | — | CN | disclosed |
| WO-2021153288-A1 | RESIN EMULSION FOR WATER-BASED INK | 株式会社日本触媒 | 2021-08-05 | — | — | WO | disclosed |
| WO-2021149548-A1 | INK-JET INK | 株式会社日本触媒 | 2021-07-29 | — | — | WO | disclosed |
| WO-2021095604-A1 | AQUEOUS POLYMER EMULSION, METHOD FOR PRODUCING SAME, AND COSMETICS | 東亞合成株式会社 | 2021-05-20 | — | — | WO | disclosed |
| US-20090286933-A1 | EMULSION FOR VIBRATING DAMPING MATERIALS | NIPPON SHOKUBAI CO., LTD. (JP) | 2009-11-19 | — | — | US | disclosed |