⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24477480 | 1.00 | — | — | |
| SCHEMBL87294 | 0.81 | — | — | |
| SCHEMBL2437271 | 0.77 | — | — | |
| SCHEMBL104322 | 0.77 | — | — | |
| SCHEMBL14723978 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL2774816 | 0.74 | — | — | |
| Bromide SCHEMBL2313189 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL20268563 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL9339715 | 0.74 | — | — | |
| SCHEMBL20621383 | 0.72 | ALDH1A1 (0.43) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210308242-A1 | FUSION PROTEINS COMPRISING AN ANTI-CD40 ANTIBODY AND CANCER ANTIGENS | BAYLOR RESEARCH INSTITUTE (US) | 2021-10-07 | — | — | US | disclosed |