⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17278963 | 0.76 | GPR3 (0.45) | — | |
| SCHEMBL12153701 | 0.71 | — | — | |
| SCHEMBL8791905 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL19139019 | 0.70 | KDM4E (0.43) | — | |
| SCHEMBL28991545 | 0.70 | — | — | |
| SCHEMBL11686226 | 0.70 | — | — | |
| SCHEMBL9255883 | 0.69 | CYP3A4 (0.51) | — | |
| SCHEMBL22528275 | 0.68 | HTR5A (0.45) | — | |
| SCHEMBL7406719 | 0.67 | HTR2A (0.53) | — | |
| SCHEMBL13157508 | 0.67 | KCNH2 (0.55) | — |
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-9475769-B2 | Zinc halide mediated cyclization process leading to tricyclic indoles | GE HEALTHCARE LIMITED (GB) | 2016-10-25 | — | — | US | disclosed |
| US-20150336891-A1 | Zinc Halide Mediated Cyclization Process Leading to Tricyclic Indoles | GE HEALTHCARE LIMITED (GB) | 2015-11-26 | — | — | US | disclosed |