Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 6/20 | 0.47 |
| ▸ | TLR2 | O60603 | 3/20 | 0.46 |
| ▸ | TLR1 | Q15399 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.43 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6567627 | 0.82 | CNR1 (0.59) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL6567565 | 0.75 | CNR1 (0.71) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL6567546 | 0.75 | CNR1 (0.64) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL6567236 | 0.74 | CNR1 (0.62) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL9667225 | 0.74 | SMN1; SMN2 (0.67) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL14049512 | 0.72 | SMN1; SMN2 (0.70) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL8350625 | 0.72 | SMN1; SMN2 (0.70) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL13923628 | 0.72 | SMN1; SMN2 (0.70) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 | |
| SCHEMBL4350075 | 0.72 | CXCR2 (0.71) | SMN1; SMN2NPSR1CXCR1EPHX2CA1 | |
| SCHEMBL6568595 | 0.72 | CNR1 (0.59) | CNR1SMN1; SMN2NPSR1EPHX2TLR2 |
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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |