⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27742755 | 0.86 | HTR1A (0.32) | — | |
| SCHEMBL668146 | 0.84 | — | — | |
| SCHEMBL7588373 | 0.82 | HTR1A (0.32) | — | |
| SCHEMBL27742663 | 0.80 | — | — | |
| Pyrrole SCHEMBL27742680 | 0.79 | HTR1A (0.33) | — | |
| Piperazine SCHEMBL28201327 | 0.79 | HTR1A (0.34) | — | |
| Phosphoric Acid SCHEMBL31510332 | 0.75 | GABRA1 (0.32) | — | |
| SCHEMBL27742665 | 0.73 | PGR (0.32) | — | |
| SCHEMBL9394087 | 0.71 | — | — | |
| SCHEMBL28117526 | 0.71 | GPR84 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101448977-B | Apparatus and process for plasma-enhanced atomic layer deposition | APPLIED MATERIALS INC | 2010-12-15 | — | — | CN | disclosed |
| CN-101448977-A | Apparatus and process for plasma-enhanced atomic layer deposition | APPLIED MATERIALS INC (US) | 2009-06-03 | — | — | CN | disclosed |