⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1493083 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL15902562 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL27841202 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL21527924 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL9306782 | 0.75 | MAOB (0.32) | — | |
| SCHEMBL9305085 | 0.75 | MAOB (0.32) | — | |
| SCHEMBL9637491 | 0.74 | MAOB (0.31) | — | |
| SCHEMBL7198219 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL444984 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL10498995 | 0.71 | ALDH1A1 (0.30) | — |
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-5171792-A | Crosslinkable saturated and unsaturated carbosilane polymers and formulations | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 1992-12-15 | — | — | US | disclosed |
| US-5130390-A | Crosslinkable saturated and unsaturated carbosilane polymers and formulations | UNIVERSITY OF SOUTHERN CALIFORNIA (US) | 1992-07-14 | — | — | US | disclosed |