⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5412372 | 0.86 | TSHR (0.36) | — | |
| SCHEMBL3336743 | 0.82 | TSHR (0.40) | — | |
| SCHEMBL3341028 | 0.82 | — | — | |
| SCHEMBL5401229 | 0.81 | TSHR (0.31) | — | |
| SCHEMBL648039 | 0.80 | DNM1 (0.35) | — | |
| SCHEMBL437305 | 0.80 | TSHR (0.30) | — | |
| SCHEMBL28619206 | 0.78 | — | — | |
| SCHEMBL14860079 | 0.77 | — | — | |
| SCHEMBL111200 | 0.76 | CYP1A2 (0.32) | — | |
| SCHEMBL1024913 | 0.76 | CYP1A2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4014835-A | GLASS FIBERS, REINFORCEMENT | OWENS-CORNING FIBERGLAS CORPORATION (US) | 1977-03-29 | — | — | US | disclosed |
| US-3988523-A | RESORCINOL-FORMALDEHYDE RESIN, ORGANOSILICON ANCHORING AGENT | OWENS-CORNING FIBERGLAS CORPORATION (US) | 1976-10-26 | — | — | US | disclosed |