⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL610951 | 0.76 | — | — | |
| SCHEMBL375346 | 0.72 | — | — | |
| SCHEMBL8057917 | 0.72 | TSHR (0.44) | — | |
| SCHEMBL12569640 | 0.71 | — | — | |
| SCHEMBL11920308 | 0.71 | ALDH1A1 (0.30) | — | |
| SCHEMBL18508411 | 0.71 | — | — | |
| SCHEMBL27722734 | 0.71 | — | — | |
| SCHEMBL6437184 | 0.69 | — | — | |
| Alcohol SCHEMBL28359582 | 0.69 | ALDH1A1 (0.41) | — | |
| Cyclopropane SCHEMBL28481284 | 0.69 | ALDH1A1 (0.41) | — |
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-20180141937-A1 | RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTOPHAGY MODULATORS AND USES THEREOF | ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) | 2018-05-24 | — | — | US | disclosed |
| US-20170037039-A1 | RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTHOPHAGY MODULATORS AND USES THEREOF | ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) | 2017-02-09 | — | — | US | disclosed |
| US-9512092-B2 | Retinoic acid receptor antagonists as chaperone-mediated autophagy modulators and uses thereof | ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) | 2016-12-06 | — | — | US | disclosed |
| US-20150166492-A1 | RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTOPHAGY MODULATORS AND USES THEREOF | ALBERT EINSTEIN COLLEGE OF MEDICINE | 2015-06-18 | — | — | US | disclosed |