Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL7141643 | 0.75 | SIGMAR1 (0.39) | SIGMAR1PDPK1 | |
| SCHEMBL30715562 | 0.75 | SIGMAR1 (0.39) | SIGMAR1PDPK1 | |
| SCHEMBL7783911 | 0.75 | SIGMAR1 (0.39) | SIGMAR1 | |
| SCHEMBL6666465 | 0.75 | SIGMAR1 (0.39) | SIGMAR1PDPK1 | |
| SCHEMBL9765060 | 0.71 | SIGMAR1 (0.38) | SIGMAR1 | |
| SCHEMBL9125425 | 0.69 | PLAU (0.43) | — | |
| SCHEMBL30724832 | 0.69 | SIGMAR1 (0.42) | SIGMAR1PDPK1 | |
| SCHEMBL10780065 | 0.69 | SIGMAR1 (0.42) | SIGMAR1PDPK1 | |
| SCHEMBL6721448 | 0.66 | SIGMAR1 (0.43) | SIGMAR1PDPK1 | |
| SCHEMBL16340795 | 0.66 | TSHR (0.35) | SIGMAR1 |
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-0785782-A1 | DISUBSTITUTED ACETYLENES BEARING HETEROAROMATIC AND HETEROBICYCLIC GROUPS HAVING RETINOID-LIKE ACTIVITY | Allergan (US) | 1997-07-30 | — | — | EP | disclosed |
| WO-1996011686-A1 | DISUBSTITUTED ACETYLENES BEARING HETEROAROMATIC AND HETEROBICYCLIC GROUPS HAVING RETINOID-LIKE ACTIVITY | ALLERGAN (US) | 1996-04-25 | — | — | WO | disclosed |
| EP-0419132-A2 | Process and intermediates for preparing compounds having a disubstituted acetylene moiety and retinoic acid-like biological activity | ALLERGAN, INC. (US) | 1991-03-27 | — | — | EP | disclosed |