⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27934672 | 0.81 | — | — | |
| SCHEMBL4407497 | 0.77 | — | — | |
| SCHEMBL8664070 | 0.73 | ALDH1A1 (0.31) | — | |
| SCHEMBL7422965 | 0.72 | ANPEP (0.33) | — | |
| SCHEMBL20985453 | 0.69 | LMNA (0.35) | — | |
| SCHEMBL27529850 | 0.65 | — | — | |
| SCHEMBL6586426 | 0.65 | CETP (0.31) | — | |
| SCHEMBL8346090 | 0.65 | — | — | |
| SCHEMBL28603397 | 0.63 | ALDH1A1 (0.35) | — | |
| SCHEMBL28446670 | 0.62 | — | — |
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-5985909-A | Cyclopropylindoles and their seco precursors, and their use as prodrugs | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1999-11-16 | — | — | US | disclosed |
| WO-1997007097-A1 | CYCLOPROPYLINDOLES AND THEIR SECO PRECURSORS, AND THEIR USE AS PRODRUGS | AUCKLAND DIVISION CANCER SOCIETY OF NEW ZEALAND INC. (NZ) | 1997-02-27 | — | — | WO | disclosed |