⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21765542 | 1.00 | — | — | |
| SCHEMBL14615992 | 1.00 | — | — | |
| SCHEMBL525855 | 0.94 | — | — | |
| SCHEMBL12262022 | 0.94 | — | — | |
| SCHEMBL3901737 | 0.94 | — | — | |
| SCHEMBL15858469 | 0.92 | CYP1A2 (0.37) | — | |
| SCHEMBL526022 | 0.92 | CYP1A2 (0.37) | — | |
| SCHEMBL12204090 | 0.92 | CYP1A2 (0.37) | — | |
| SCHEMBL612657 | 0.92 | CYP1A2 (0.37) | — | |
| SCHEMBL22609040 | 0.90 | ANPEP (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012014109-A1 | HETEROCYCLIC SULFONAMIDES AS INHIBITORS OF TRANSFER RNA SYNTHETASE FOR USE AS ANTIBACTERIAL AGENTS | RANBAXY LABORATORIES LIMITED (IN) | 2012-02-02 | — | — | WO | disclosed |
| US-20070032413-A1 | Human secreted proteins | HUMAN GENOME SCIENCES, INC. | 2007-02-08 | — | — | US | disclosed |