⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8215728 | 0.73 | CYP1A2 (0.41) | — | |
| SCHEMBL9115571 | 0.73 | — | — | |
| SCHEMBL15236107 | 0.69 | — | — | |
| SCHEMBL16701285 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL28087942 | 0.67 | — | — | |
| SCHEMBL21501079 | 0.67 | — | — | |
| SCHEMBL11274107 | 0.65 | — | — | |
| SCHEMBL28574281 | 0.65 | — | — | |
| SCHEMBL4710409 | 0.65 | — | — | |
| SCHEMBL28967068 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106390118-A | SLIT-ROBO SIGNALING FOR DIAGNOSIS AND TREATMENT OF KIDNEY DISEASE | 波士顿医疗中心有限公司 | 2017-02-15 | — | — | CN | disclosed |