Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | C5AR1 | P21730 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP7 | P09237 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9998902 | 0.89 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998566 | 0.87 | SMN1; SMN2 (0.40) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998573 | 0.86 | PYGL (0.36) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998565 | 0.85 | SMN1; SMN2 (0.39) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998907 | 0.85 | SMN1; SMN2 (0.39) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998431 | 0.84 | SMN1; SMN2 (0.39) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998090 | 0.84 | ALDH1A1 (0.33) | SMN1; SMN2ALDH1A1TSHRKMT2ACTSS | |
| SCHEMBL9998695 | 0.83 | SMN1; SMN2 (0.38) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL15996143 | 0.76 | ALDH1A1 (0.40) | SMN1; SMN2ALDH1A1TSHRL3MBTL1KMT2A | |
| SCHEMBL9998556 | 0.76 | SMN1; SMN2 (0.38) | SMN1; SMN2ALDH1A1TSHRKMT2ALMNA |
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-2582692-A1 | CYCLOHEXYL-AZETIDINYL ANTAGONISTS OF CCR2 | Janssen Pharmaceutica, N.V. (BE) | 2013-04-24 | — | — | EP | disclosed |
| WO-2011159854-A1 | CYCLOHEXYL-AZETIDINYL ANTAGONISTS OF CCR2 | JANSSEN PHARMACEUTICA NV (BE) | 2011-12-22 | — | — | WO | disclosed |