⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7353253 | 0.83 | — | — | |
| SCHEMBL5548707 | 0.73 | SIGMAR1 (0.42) | — | |
| SCHEMBL5542432 | 0.69 | CRBN (0.30) | — | |
| SCHEMBL2408554 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL12520638 | 0.64 | JAK2 (0.30) | — | |
| SCHEMBL1533841 | 0.62 | PPARA (0.32) | — | |
| SCHEMBL8128467 | 0.61 | — | — | |
| SCHEMBL3766132 | 0.61 | — | — | |
| SCHEMBL4002019 | 0.60 | — | — | |
| SCHEMBL11100936 | 0.60 | JAK2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103068830-B | Arginase inhibitors and therapeutic uses thereof | 马尔斯公司 | 2016-06-29 | — | — | CN | disclosed |
| CN-104876955-A | Inhibitors Of Arginase And Their Therapeutic Applications | MARS INC | 2015-09-02 | — | — | CN | disclosed |