⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL351946 | 0.79 | EPHX1 (0.39) | — | |
| SCHEMBL16622567 | 0.79 | TLR4 (0.30) | — | |
| SCHEMBL13240744 | 0.76 | ESR2 (0.45) | — | |
| SCHEMBL18543770 | 0.76 | — | — | |
| SCHEMBL12525042 | 0.76 | ESR2 (0.45) | — | |
| SCHEMBL12528053 | 0.76 | ESR2 (0.45) | — | |
| SCHEMBL16378093 | 0.74 | TSHR (0.35) | — | |
| Hydrochloric Acid SCHEMBL13275334 | 0.74 | ESR2 (0.44) | — | |
| SCHEMBL10635038 | 0.74 | PLG (0.38) | — | |
| Hydrochloric Acid SCHEMBL13275335 | 0.74 | ESR2 (0.44) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220106324-A1 | DISPIROPYRROLIDINE DERIVATIVES | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2022-04-07 | — | — | US | disclosed |
| EP-2684880-B1 | DISPIROPYRROLIDINE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2018-02-28 | — | — | EP | disclosed |
| EP-0954606-B1 | NON-NUCLEOTIDE LINKING REAGENTS | BIOGENEX LAB (US) | 2003-10-15 | — | — | EP | disclosed |
| US-6130323-A | Non-nucleotide linking reagents | BIOGENEX LABORATORIES (US) | 2000-10-10 | — | — | US | disclosed |