⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24938536 | 0.93 | ESR1 (0.30) | — | |
| SCHEMBL21719182 | 0.76 | — | — | |
| SCHEMBL23784452 | 0.73 | RIPK1 (0.34) | — | |
| SCHEMBL21719335 | 0.72 | CNR2 (0.33) | — | |
| SCHEMBL15218365 | 0.70 | ALOX5AP (0.32) | — | |
| SCHEMBL21719323 | 0.70 | CNR2 (0.31) | — | |
| SCHEMBL21718506 | 0.69 | CNR2 (0.31) | — | |
| SCHEMBL24305005 | 0.67 | ESR1 (0.40) | — | |
| SCHEMBL21719249 | 0.67 | — | — | |
| SCHEMBL21064262 | 0.67 | KCNH2 (0.39) | — |
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-11071730-B2 | Substituted 6-azabenzimidazole compounds | GILEAD SCIENCES, INC. (US) | 2021-07-27 | — | — | US | disclosed |
| US-20200171020-A1 | SUBSTITUTED 6-AZABENZIMIDAZOLE COMPOUNDS | GILEAD SCIENCES, INC. | 2020-06-04 | — | — | US | disclosed |