⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6243027 | 0.90 | — | — | |
| SCHEMBL264289 | 0.90 | — | — | |
| SCHEMBL7929182 | 0.87 | — | — | |
| Bromide SCHEMBL7877090 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL460378 | 0.87 | — | — | |
| Water SCHEMBL274857 | 0.87 | — | — | |
| Iodide SCHEMBL7058984 | 0.87 | — | — | |
| Cyanide SCHEMBL7573657 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL7931820 | 0.81 | — | — | |
| Bicarbonate SCHEMBL9960105 | 0.81 | CA1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6297332-B1 | FOR SEALING A SEMICONDUCTOR INTEGRATED CIRCUIT, AMINOPHOSPHINE OXIDE AS IMPROVED ACCELERATING AGENT, PACKAGE BETTER IN CRACK RESISTANCE | MITSUI CHEMICALS, INC. (JP) | 2001-10-02 | — | — | US | disclosed |
| EP-0953588-A2 | An epoxy-resin composition and use thereof | Mitsui Chemicals, Inc. (JP) | 1999-11-03 | — | — | EP | disclosed |