⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2269499 | 1.00 | — | — | |
| SCHEMBL17042948 | 1.00 | — | — | |
| SCHEMBL17042949 | 1.00 | — | — | |
| SCHEMBL17043001 | 1.00 | — | — | |
| SCHEMBL17042046 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL3609098 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL3607849 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL3607842 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL3607844 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL3609103 | 0.98 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015128334-A9 | 3H-THIENO[3,4]PYRIMIDIN-4-ONEAND PYRROLOPYRIMID-4-ONE AS GRAM-POSITIVE ANTIBACTERIAL AGENTS | LABORATOIRE BIODIM (FR) | 2015-10-15 | — | — | WO | disclosed |
| WO-2015128334-A1 | 3H-THIENO[3,4]PYRIMIDIN-4-ONEAND PYRROLOPYRIMID-4-ONE AS GRAM-POSITIVE ANTIBACTERIAL AGENTS | LABORATOIRE BIODIM (FR) | 2015-09-03 | — | — | WO | disclosed |
| CN-1639109-A | Kinetic resolution of isomers and resolved isomers | BRISTOL MYERS SQUIBB CO (US) | 2005-07-13 | — | — | CN | disclosed |