⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3337079 | 0.88 | TSHR (0.35) | — | |
| SCHEMBL27397047 | 0.84 | MAPT (0.33) | — | |
| SCHEMBL28960605 | 0.82 | ALDH1A1 (0.47) | — | |
| SCHEMBL27397879 | 0.82 | MAPT (0.33) | — | |
| SCHEMBL27566173 | 0.81 | ACHE (0.32) | — | |
| Hydrochloric Acid SCHEMBL27552872 | 0.81 | ALDH1A1 (0.45) | — | |
| SCHEMBL4465007 | 0.81 | ALOX15 (0.48) | — | |
| SCHEMBL24095944 | 0.79 | NAAA (0.48) | — | |
| SCHEMBL7780258 | 0.79 | NAAA (0.48) | — | |
| SCHEMBL7782123 | 0.79 | NAAA (0.48) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1088020-A1 | FUNCTIONALISED POLYMERS OF ALPHA-AMINO ACIDS AND THE METHOD OF PREPARATION THEREOF | USTAV MAKROMOLEKULARNI CHEMIE AKADEMIE VED CESKE REPUBLIKY (CZ) | 2001-04-04 | — | — | EP | claimed |
| WO-1999064495-A1 | FUNCTIONALISED POLYMERS OF α-AMINO ACIDS AND THE METHOD OF PREPARATION THEREOF | ÚSTAV MAKROMOLEKULÁRNÍ CHEMIE AKADEMIE VĚD ČESKÉ REPUBLIKY (CZ) | 1999-12-16 | — | — | WO | claimed |
| CN-103665170-A | Peptide therapeutic conjugates and uses thereof | ANGIOCHEM INC | 2014-03-26 | — | — | CN | disclosed |