Predicted protein targets (top 2)
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL10496811 | 0.78 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL3800854 | 0.77 | TSHR (0.43) | TSHR | |
| SCHEMBL28678611 | 0.74 | CA2 (0.38) | TSHRTDP1 | |
| SCHEMBL21992098 | 0.72 | CA1 (0.40) | — | |
| SCHEMBL3064643 | 0.70 | TSHR (0.32) | TSHR | |
| SCHEMBL5861271 | 0.69 | — | — | |
| SCHEMBL10372952 | 0.69 | TSHR (0.31) | TSHR | |
| SCHEMBL9938412 | 0.69 | TSHR (0.31) | TSHR | |
| SCHEMBL28993590 | 0.65 | TSHR (0.58) | TSHRTDP1 | |
| SCHEMBL2454366 | 0.63 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7026473-B2 | Process for the carbonylation of pentenenitrile | SHELL OIL COMPANY (US) | 2006-04-11 | — | — | US | disclosed |