⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17383858 | 0.88 | — | — | |
| SCHEMBL12809630 | 0.81 | — | — | |
| SCHEMBL16948506 | 0.78 | CARM1 (0.39) | — | |
| SCHEMBL347764 | 0.78 | CARM1 (0.39) | — | |
| SCHEMBL6131298 | 0.78 | CARM1 (0.39) | — | |
| SCHEMBL341303 | 0.78 | — | — | |
| SCHEMBL13663850 | 0.78 | CA12 (0.69) | — | |
| SCHEMBL17742235 | 0.78 | CA12 (0.69) | — | |
| SCHEMBL1273998 | 0.78 | CA12 (0.69) | — | |
| SCHEMBL1276538 | 0.78 | CA12 (0.69) | — |
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-20210076979-A1 | DEVICE FOR MEASURING A PERSON'S VENTILATION INCLUDING OXYGEN-CONSUMPTION | VO2 MASTER HEALTH SENSORS INC. (CA) | 2021-03-18 | — | — | US | disclosed |
| WO-2020112846-A1 | SMALL MOLECULE MODULATORS OF SIGMA-1 AND SIGMA-2 RECEPTORS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2020-06-04 | — | — | WO | disclosed |