⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL240584 | 0.73 | — | — | |
| SCHEMBL5491194 | 0.73 | — | — | |
| SCHEMBL15013705 | 0.70 | — | — | |
| SCHEMBL10453213 | 0.70 | — | — | |
| Bromide SCHEMBL5516150 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5977714 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL2222 | 0.70 | — | — | |
| SCHEMBL19865399 | 0.69 | — | — | |
| SCHEMBL8437555 | 0.69 | DGAT1 (0.42) | — | |
| SCHEMBL12482611 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102083845-B | Cyclopropyl polymerase inhibitors | 森托科尔奥索生物科技产品股份有限公司 | 2016-09-14 | — | — | CN | disclosed |
| CN-105693794-A | Cyclopropyl polymerase inhibitors | 杨森产品有限公司 | 2016-06-22 | — | — | CN | disclosed |
| CN-101166750-A | Furanopyrimidine compounds and thienopyrimidine compounds for therapy | BIOCRYST PHARM INC (US) | 2008-04-23 | — | — | CN | disclosed |