Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB2 | Q96IY4 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2407458 | 0.78 | CYP2C19 (0.32) | CPB2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL5728858 | 0.74 | HDAC1 (0.33) | CPB2MEN1KMT2A | |
| SCHEMBL18549878 | 0.74 | — | — | |
| SCHEMBL19767 | 0.71 | CPB2 (0.35) | CPB2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL165219 | 0.69 | CYP2C19 (0.34) | CPB2CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL22294115 | 0.69 | CYP2C19 (0.34) | CYP2C19MEN1CYP2C9KMT2A | |
| SCHEMBL28884484 | 0.69 | CYP2C19 (0.58) | CPB2CYP2C19 | |
| SCHEMBL11221000 | 0.68 | SIRT2 (0.43) | CPB2MEN1KMT2A | |
| SCHEMBL18466212 | 0.68 | — | — | |
| SCHEMBL17049040 | 0.68 | CPB2 (0.39) | CPB2MEN1KMT2A |
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-1615699-A2 | BENZOXAZINYL-AMIDOCYCLOPENTYL-HETEROCYCLIC MODULATORS OF CHEMOKINE RECEPTORS | Merck & Co., Inc. (US) | 2006-01-18 | — | — | EP | disclosed |
| WO-2004092124-A2 | BENZOXAZINYL-AMIDOCYCLOPENTYL-HETEROCYCLIC MODULATORS OF CHEMOKINE RECEPTORS | MERCK & CO., INC. (US) | 2004-10-28 | — | — | WO | disclosed |