⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4044909 | 1.00 | — | — | |
| SCHEMBL9084961 | 1.00 | — | — | |
| SCHEMBL12769948 | 0.77 | — | — | |
| SCHEMBL10402929 | 0.76 | — | — | |
| SCHEMBL8823325 | 0.76 | — | — | |
| SCHEMBL9180674 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL5157290 | 0.74 | — | — | |
| SCHEMBL14969524 | 0.74 | — | — | |
| SCHEMBL751417 | 0.74 | — | — | |
| SCHEMBL2192426 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014097257-A1 | A METHOD OF PREPARATION OF (1'R,3R,4R)-4-ACETOXY-3-(1'-(TERT-BUTYLDIMETHYLSILYLOXY)ETHYL)-2-AZETIDINONE, A PRECURSOR FOR CARBAPENEM ANTIBIOTICS SYNTHESIS | INSTYTUT CHEMII ORGANICZNEJ PAN (PL) | 2014-06-26 | — | — | WO | disclosed |
| EP-1702919-B1 | NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE | MSD KK (JP) | 2012-05-30 | — | — | EP | disclosed |
| US-7728025-B2 | 2-heteroaryl-substituted benzimidazole derivative | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2010-06-01 | — | — | US | disclosed |
| US-20080070928-A1 | Novel 2-Heteroaryl-Substituted Benzimidazole Derivative | MSD K.K. (JP) | 2008-03-20 | — | — | US | disclosed |
| EP-1702919-A1 | NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2006-09-20 | — | — | EP | disclosed |