⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL899641 | 0.97 | HPGD (0.33) | — | |
| SCHEMBL23081736 | 0.97 | HPGD (0.33) | — | |
| SCHEMBL98197 | 0.97 | — | — | |
| SCHEMBL27867937 | 0.93 | — | — | |
| SCHEMBL26038847 | 0.88 | HPGD (0.30) | — | |
| SCHEMBL8572539 | 0.88 | — | — | |
| SCHEMBL8568492 | 0.88 | — | — | |
| SCHEMBL6562718 | 0.85 | CA1 (0.37) | — | |
| SCHEMBL8456551 | 0.85 | — | — | |
| SCHEMBL13447535 | 0.84 | HPGD (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0205536-B1 | SEPARATION OF ISOMERS OF CYCLOPROPANE CARBOXYLIC ACIDS | CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) | 1988-07-13 | — | — | EP | disclosed |
| EP-0205536-A1 | SEPARATION OF ISOMERS OF CYCLOPROPANE CARBOXYLIC ACIDS. | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1986-12-30 | — | — | EP | disclosed |
| WO-1986003487-A1 | SEPARATION OF ISOMERS OF CYCLOPROPANE CARBOXYLIC ACIDS | Chinoin Gyógyszer és Vegyészeti Termékek Gyára Rt. (HU) | 1986-06-19 | — | — | WO | disclosed |