Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNE1 | P24864 | 8/20 | 0.35 |
| ▸ | CDK2 | P24941 | 8/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 8/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL627862 | 0.76 | CCNE1 (0.46) | CCNE1CDK2CDK5CDK5R1SMN1; SMN2 | |
| SCHEMBL628009 | 0.63 | ESR2 (0.41) | CCNE1CDK2CDK5CDK5R1ALDH1A1 | |
| SCHEMBL22048060 | 0.60 | CRBN (0.41) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL20883073 | 0.59 | CCNE1 (0.49) | CCNE1CDK2CDK5CDK5R1SMN1; SMN2 | |
| SCHEMBL19868941 | 0.59 | PDE4A (0.43) | PDE10AALDH1A1 | |
| SCHEMBL3905860 | 0.59 | CDK2 (0.41) | CCNE1CDK2CDK5CDK5R1SMN1; SMN2 | |
| SCHEMBL5835977 | 0.58 | CDK2 (0.55) | CCNE1CDK2CDK5CDK5R1ALDH1A1 | |
| SCHEMBL19984560 | 0.58 | ESR2 (0.32) | — | |
| SCHEMBL12341805 | 0.58 | SMN1; SMN2 (0.37) | PDE10AALDH1A1SMN1; SMN2 | |
| SCHEMBL27994759 | 0.58 | MAPK1 (0.50) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010121011-A1 | 4-AZETIDINYL-1-HETEROARYL-CYCLOHEXANE ANTAGONISTS OF CCR2 | JANSSEN PHARMACEUTICA NV (BE) | 2010-10-21 | — | — | WO | disclosed |