⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29162961 | 0.78 | HTR2C (0.31) | — | |
| SCHEMBL27662562 | 0.73 | GABRA1 (0.32) | — | |
| SCHEMBL6673395 | 0.72 | IMPDH2 (0.44) | — | |
| SCHEMBL2906588 | 0.69 | CES2 (0.36) | — | |
| SCHEMBL29672634 | 0.69 | CES2 (0.36) | — | |
| SCHEMBL1507657 | 0.68 | IMPDH2 (0.37) | — | |
| SCHEMBL6053320 | 0.68 | POLB (0.33) | — | |
| SCHEMBL10986339 | 0.68 | XDH (0.31) | — | |
| SCHEMBL26363 | 0.67 | CES2 (0.41) | — | |
| SCHEMBL31467839 | 0.66 | TRPV4 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5820785-A | ELECTROOPTIC SWITCHES; DISPLAYING | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-10-13 | — | — | US | claimed |
| US-5820785-A | ELECTROOPTIC SWITCHES; DISPLAYING | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-10-13 | — | — | US | disclosed |
| US-5820785-A | ELECTROOPTIC SWITCHES; DISPLAYING | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-10-13 | — | — | US | disclosed |
| US-5820785-A | ELECTROOPTIC SWITCHES; DISPLAYING | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-10-13 | — | — | US | disclosed |