⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3070171 | 0.79 | — | — | |
| SCHEMBL3081263 | 0.76 | FAAH (0.34) | — | |
| SCHEMBL28272873 | 0.75 | — | — | |
| SCHEMBL28195215 | 0.75 | — | — | |
| SCHEMBL1297846 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL3355086 | 0.72 | LMNA (0.48) | — | |
| Succinamide SCHEMBL28157588 | 0.71 | LMNA (0.50) | — | |
| Succinamide SCHEMBL36057 | 0.71 | — | — | |
| SCHEMBL10425752 | 0.70 | — | — | |
| SCHEMBL27532320 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3173408-A1 | PHENYL TETRAHYDROISOQUINOLINE COMPOUND SUBSTITUTED WITH HETEROARYL | Taisho Pharmaceutical Co., Ltd. (JP) | 2017-05-31 | — | — | EP | disclosed |
| EP-2035401-A2 | ARYL- AND HETEROARYL-ETHYL-ACYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS | Sanofi-Aventis (FR) | 2009-03-18 | — | — | EP | disclosed |
| WO-2007144769-A2 | ARYL- AND HETEROARYL-ETHYL-ACYLGUANIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS | SANOFI-AVENTIS (FR) | 2007-12-21 | — | — | WO | disclosed |