⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14402220 | 0.92 | — | — | |
| SCHEMBL17115809 | 0.89 | GPR84 (0.52) | — | |
| SCHEMBL18862808 | 0.84 | SLC22A6 (0.39) | — | |
| SCHEMBL10160296 | 0.84 | LMNA (0.39) | — | |
| SCHEMBL14475292 | 0.81 | — | — | |
| SCHEMBL18386700 | 0.81 | TSHR (0.42) | — | |
| SCHEMBL21467449 | 0.81 | TSHR (0.42) | — | |
| SCHEMBL14641650 | 0.77 | LMNA (0.31) | — | |
| SCHEMBL19193496 | 0.76 | FFAR1 (0.40) | — | |
| SCHEMBL23739076 | 0.74 | SLC22A6 (0.61) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0954545-B1 | Packaging article comprising additive transfer film suitable for cook-in end use | CRYOVAC INC (US) | 2003-04-23 | — | — | EP | claimed |
| US-20140162327-A1 | MICROORGANISMS AND METHODS FOR THE COPRODUCTION 1,4-BUTANEDIOL AND GAMMA-BUTYROLACTONE | AGAIN BIO APS (DK) | 2014-06-12 | — | — | US | disclosed |