⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6567125 | 0.74 | GPR3 (0.33) | — | |
| SCHEMBL9409548 | 0.69 | GPR3 (0.46) | — | |
| Butadiene SCHEMBL7646824 | 0.68 | — | — | |
| SCHEMBL21728739 | 0.63 | HTR2A (0.42) | — | |
| SCHEMBL8466615 | 0.62 | POLB (0.39) | — | |
| SCHEMBL8577456 | 0.59 | GPR3 (0.33) | — | |
| SCHEMBL8466173 | 0.59 | GPR3 (0.33) | — | |
| SCHEMBL5907757 | 0.59 | MAPT (0.34) | — | |
| SCHEMBL6908754 | 0.57 | GPR3 (0.33) | — | |
| SCHEMBL4062877 | 0.57 | GPR3 (0.33) | — |
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-2057205-A2 | PRODUCTION OF META-BLOCK COPOLYMERS BY POLYMER SEGMENT INTERCHANGE | Dow Global Technologies Inc. (US) | 2009-05-13 | — | — | EP | disclosed |
| WO-2008027283-A2 | PRODUCTION OF META-BLOCK COPOLYMERS BY POLYMER SEGMENT INTERCHANGE | DOW GLOBAL TECHNOLOGIES INC. (US) | 2008-03-06 | — | — | WO | disclosed |