⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12112393 | 1.00 | — | — | |
| SCHEMBL3315690 | 0.92 | OPRM1 (0.44) | — | |
| SCHEMBL8107298 | 0.92 | OPRM1 (0.44) | — | |
| SCHEMBL3315460 | 0.90 | ACE2 (0.45) | — | |
| SCHEMBL17772681 | 0.90 | ACE2 (0.45) | — | |
| SCHEMBL3314131 | 0.90 | ACE2 (0.45) | — | |
| SCHEMBL28320909 | 0.86 | OPRM1 (0.39) | — | |
| SCHEMBL28234726 | 0.86 | LMNA (0.43) | — | |
| SCHEMBL1508328 | 0.83 | — | — | |
| SCHEMBL15305566 | 0.83 | — | — |
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-20130149239-A1 | 5-PYRROLIDINYLSULFONYL-ISATIN DERIVATIVES | UNIVERSITATSKLINIKUM MUNSTER (DE) | 2013-06-13 | — | — | US | disclosed |
| US-20090226411-A1 | CHEMICAL DERIVATIVES AND THEIR APPLICATION AS ANTITELOMERASE AGENTS | AVENTIS PHARMA S.A. (FR) | 2009-09-10 | — | — | US | disclosed |