⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13403383 | 1.00 | — | — | |
| SCHEMBL4043563 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL4043560 | 0.98 | EGLN1 (0.55) | — | |
| Hydrochloric Acid SCHEMBL4043567 | 0.98 | EGLN1 (0.55) | — | |
| SCHEMBL746387 | 0.79 | EGLN1 (0.52) | — | |
| SCHEMBL14097927 | 0.77 | — | — | |
| SCHEMBL6945206 | 0.77 | — | — | |
| SCHEMBL3153890 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL17979364 | 0.71 | — | — | |
| SCHEMBL18684468 | 0.70 | CHRNB2 (0.35) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117447382-A | Preparation method of tetrahydropyrrolo cyclopropane | 武汉瑞晟药业有限公司 | 2024-01-26 | — | — | CN | disclosed |
| CN-114057627-B | Preparation method of hepatitis C and neocorolla drug intermediate and salt thereof | 南京桦冠生物技术有限公司 | 2022-04-01 | — | — | CN | disclosed |
| US-20110201599-A1 | CDK Modulators | EXELIXIS, INC. (US) | 2011-08-18 | — | — | US | disclosed |
| US-7691843-B2 | N-hydroxyamide derivatives possessing antibacterial activity | PFIZER INC. (US) | 2010-04-06 | — | — | US | disclosed |
| US-20090005575-A1 | Preparation of diazapentalene derivatives via epoxydation of dihydropyrroles | AMURA THERAPEUTICS LTD. (GB) | 2009-01-01 | — | — | US | disclosed |
| CN-101273044-A | Preparation of diaza-pentalene derivatives by epoxidation of dihydropyrroles | AMURA THERAPEUTICS LTD (GB) | 2008-09-24 | — | — | CN | disclosed |
| EP-1917266-A1 | PREPARATION OF DIAZAPENTALENE DERIVATIVES VIA EPOXYDATION OF DIHYDROPYRROLES | Amura Therapeutics Limited (GB) | 2008-05-07 | — | — | EP | disclosed |
| US-20080058304-A1 | N-hydroxyamide derivatives possessing antibacterial activity | VICURON HOLDINGS LLC | 2008-03-06 | — | — | US | disclosed |
| WO-2007017698-A1 | PREPARATION OF DIAZAPENTALENE DERIVATIVES VIA EPOXYDATION OF DIHYDROPYRROLES | AMURA THERAPEUTICS LIMITED (GB) | 2007-02-15 | — | — | WO | disclosed |