Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
The experimentally established mechanism targets of Pyrrole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Pyrrole SCHEMBL11400115 | 0.90 | — | — | |
| Pyrrole SCHEMBL22412640 | 0.90 | — | — | |
| Pyrrole SCHEMBL10797033 | 0.90 | — | — | |
| Pyrrole SCHEMBL27535135 | 0.89 | — | — | |
| Pyrrole SCHEMBL15757584 | 0.89 | — | — | |
| Pyrrole SCHEMBL15801170 | 0.89 | — | — | |
| Pyrrole SCHEMBL292 | 0.89 | — | — | |
| Pyrrole SCHEMBL841068 | 0.89 | — | — | |
| Pyrrole SCHEMBL2885785 | 0.89 | — | — | |
| Pyrrole SCHEMBL14840876 | 0.89 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001002353-A1 | METHOD FOR PRODUCING A 4-(PYRROLE-1-YL)-BENZOYLGUANIDINE DERIVATIVE | MERCK PATENT GMBH (DE) | 2001-01-11 | — | — | WO | disclosed |