⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18068013 | 0.78 | P2RX3 (0.35) | — | |
| SCHEMBL20642314 | 0.74 | P2RX3 (0.36) | — | |
| SCHEMBL20642405 | 0.74 | ALOX5AP (0.32) | — | |
| SCHEMBL21446969 | 0.72 | NOS3 (0.31) | — | |
| SCHEMBL12749932 | 0.70 | ALOX5AP (0.35) | — | |
| SCHEMBL20642375 | 0.70 | GLP1R (0.34) | — | |
| SCHEMBL12749928 | 0.68 | TAS1R3 (0.32) | — | |
| SCHEMBL12749929 | 0.67 | NPC1 (0.31) | — | |
| SCHEMBL24244807 | 0.66 | ALDH1A1 (0.37) | — | |
| SCHEMBL25910806 | 0.65 | APLNR (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10695348-B2 | Sulfonyl pyridyl TRP inhibitors | GENENTECH, INC. (US) | 2020-06-30 | — | — | US | disclosed |
| US-20190167681-A1 | SULFONYL PYRIDYL TRP INHIBITORS | GENENTECH, INC. (US) | 2019-06-06 | — | — | US | disclosed |