⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14744974 | 1.00 | — | — | |
| SCHEMBL14745203 | 0.84 | HSD17B3 (0.37) | — | |
| SCHEMBL16440986 | 0.83 | DHFR (0.34) | — | |
| SCHEMBL16428739 | 0.80 | NPC1 (0.33) | — | |
| SCHEMBL14745543 | 0.79 | SIGMAR1 (0.34) | — | |
| SCHEMBL14745668 | 0.79 | HCAR3 (0.40) | — | |
| SCHEMBL14745601 | 0.77 | MEN1 (0.46) | — | |
| SCHEMBL14745600 | 0.77 | MEN1 (0.46) | — | |
| SCHEMBL14745193 | 0.75 | MCL1 (0.41) | — | |
| SCHEMBL14745877 | 0.74 | HPGD (0.35) | — |
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-9409905-B2 | Antibacterial compounds and methods for use | PTC THERAPEUTICS, INC. (US) | 2016-08-09 | — | — | US | disclosed |
| US-20150038437-A1 | ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE | PTC THERAPEUTICS, INC. (US) | 2015-02-05 | — | — | US | disclosed |
| EP-2750504-A1 | ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE | PTC Therapeutics, Inc. (US) | 2014-07-09 | — | — | EP | disclosed |
| WO-2013033258-A1 | ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE | PTC THERAPEUTICS, INC. (US) | 2013-03-07 | — | — | WO | disclosed |