⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10051020 | 0.92 | FAAH (0.42) | — | |
| SCHEMBL3123283 | 0.87 | FAAH (0.55) | — | |
| SCHEMBL3116397 | 0.85 | FAAH (0.59) | — | |
| SCHEMBL3115654 | 0.84 | FAAH (0.62) | — | |
| SCHEMBL3121874 | 0.84 | FAAH (0.62) | — | |
| SCHEMBL3119173 | 0.84 | FAAH (0.62) | — | |
| SCHEMBL3116518 | 0.84 | FAAH (0.62) | — | |
| SCHEMBL3111434 | 0.84 | FAAH (0.62) | — | |
| SCHEMBL9968526 | 0.83 | CNR1 (0.50) | — | |
| SCHEMBL13938722 | 0.81 | MAPT (0.48) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016044585-A1 | ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF | Epizyme, Inc. (US) | 2016-03-24 | — | — | WO | disclosed |
| US-8084395-B2 | 4-aza indole derivatives and their use as fungicides | SYNGENTA CROP PROTECTION, INC. (US) | 2011-12-27 | — | — | US | disclosed |
| US-20100184598-A1 | 4-AZA INDOLE DERIVATIVES AND THEIR USE AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2010-07-22 | — | — | US | disclosed |
| US-4179292-A | Light-sensitive copying composition | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-12-18 | — | — | US | disclosed |