⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12695255 | 0.86 | DNM1 (0.30) | — | |
| SCHEMBL11200 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL12588605 | 0.77 | — | — | |
| SCHEMBL14408045 | 0.74 | EPHX1 (0.46) | — | |
| SCHEMBL373996 | 0.74 | ADRB2 (0.33) | — | |
| SCHEMBL14997895 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL19973227 | 0.74 | — | — | |
| SCHEMBL1002360 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL12451674 | 0.72 | — | — | |
| SCHEMBL804367 | 0.72 | TSHR (0.42) | — |
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-9079997-B2 | Modification of polymers containing an anhydride and uses thereof | ISP INVESTMENTS INC. (US) | 2015-07-14 | — | — | US | disclosed |
| US-20130150520-A1 | MODIFICATION OF POLYMERS CONTAINING AN ANHYDRIDE AND USES THEREOF | ISP INVESTMENTS INC. (US) | 2013-06-13 | — | — | US | disclosed |