Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10194129 | 0.91 | SMPD1 (0.51) | SMPD1NOTUMHRH3ALDH1A1 | |
| SCHEMBL26928299 | 0.85 | NOTUM (0.44) | SMPD1NOTUMALDH1A1MAPT | |
| SCHEMBL7303479 | 0.80 | NOTUM (0.43) | NOTUMHRH3 | |
| SCHEMBL3154694 | 0.77 | — | — | |
| SCHEMBL14228524 | 0.76 | SMPD1 (0.47) | SMPD1HRH3ALDH1A1 | |
| SCHEMBL22961451 | 0.76 | CHRM2 (0.49) | SMPD1ALDH1A1LMNAMAPTHTT | |
| SCHEMBL6128431 | 0.74 | SMPD1 (0.44) | SMPD1NOTUMHRH3ALDH1A1 | |
| SCHEMBL10157733 | 0.73 | — | — | |
| SCHEMBL322866 | 0.72 | SMPD1 (0.53) | SMPD1NOTUM | |
| SCHEMBL5888245 | 0.72 | SMPD1 (0.57) | SMPD1ALDH1A1LMNATDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7052742-B1 | Five membered-ring compounds and utilization thereof in liquid crystal mixtures | CLARIANT INTERNATIONAL LTD. (CH) | 2006-05-30 | — | — | US | disclosed |
| EP-1214316-A1 | FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES | CLARIANT INTERNATIONAL LTD. (CH) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001016131-A2 | FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES | CLARIANT INTERNATIONAL LTD (CH) | 2001-03-08 | — | — | WO | disclosed |