⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL27820268 | 0.97 | — | — | |
| Phosphorylisopropane SCHEMBL10821980 | 0.79 | — | — | |
| SCHEMBL8724557 | 0.78 | — | — | |
| SCHEMBL7731451 | 0.76 | — | — | |
| SCHEMBL8399407 | 0.75 | CTSA (0.50) | — | |
| SCHEMBL268599 | 0.75 | CTSA (0.50) | — | |
| Phosphorylisopropane SCHEMBL82996 | 0.75 | — | — | |
| SCHEMBL6681748 | 0.75 | CTSA (0.50) | — | |
| SCHEMBL21010143 | 0.74 | — | — | |
| SCHEMBL29988984 | 0.74 | TSHR (0.36) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110461157-B | Herbicidal mixtures | 拜耳公司 | 2021-11-02 | — | — | CN | claimed |
| US-20200362337-A1 | OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF | WAVE LIFE SCIENCES LTD. (SG) | 2020-11-19 | — | — | US | disclosed |
| CN-101056534-B | Nematode resistant transgenic plants | UNIV GEORGIA RES FOUND | 2012-10-10 | — | — | CN | disclosed |
| CN-101056534-A | Nematode resistant transgenic plants | UNIV GEORGIA RES FOUND (US) | 2007-10-17 | — | — | CN | disclosed |
| US-5948671-A | Control of replant disease of tree fruits with Pseudomonas putida | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1999-09-07 | — | — | US | disclosed |
| US-4975425-A | COMPOSITION FORMED FROM ALCOHOL, A MODIFIED COCODIETHANOLAMIDE AND WATER; RAPID ABSORPTION | MOBAY CORPORATION (US) | 1990-12-04 | — | — | US | disclosed |