⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22970 | 0.87 | — | — | |
| SCHEMBL6660010 | 0.80 | — | — | |
| Bromide SCHEMBL27834284 | 0.80 | — | — | |
| SCHEMBL389591 | 0.80 | — | — | |
| Ammonia Solution, Strong SCHEMBL28211772 | 0.80 | — | — | |
| Cyanide SCHEMBL28334413 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL27262812 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL27262811 | 0.75 | — | — | |
| Propane SCHEMBL9504810 | 0.72 | — | — | |
| Benzene SCHEMBL10829359 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0107693-B1 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLIN-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) | 1988-07-27 | — | — | EP | disclosed |
| US-4638002-A | ANTIAGGLOMERANTS, HYPOTENSIVE, ANTISECRETORY, ANTISPASMODIC, ANTIULCER, BRONCHODILATOR, ANTIHISTAMINES | CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1987-01-20 | — | — | US | disclosed |
| EP-0107693-A4 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLIN-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME. | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1984-09-17 | — | — | EP | disclosed |
| EP-0107693-A1 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLIN-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME. | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1984-05-09 | — | — | EP | disclosed |
| WO-1983004021-A1 | 2,3,4-TRINOR-1,5-INTER-M-PHENYLENE-PROSTACYCLINE-I2 ANALOGUES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | Chinoin Gyógyszer és Vegyészeti Termékek Gyára Rt. (HU) | 1983-11-24 | — | — | WO | disclosed |