Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 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 | |
|---|---|---|---|---|
| SCHEMBL7744780 | 0.95 | CASP1 (0.36) | SMN1; SMN2ALDH1A1HSD17B10CASP1POLB | |
| SCHEMBL7744793 | 0.88 | HSD17B10 (0.38) | ALDH1A1HSD17B10CASP1KMT2AKCNN4 | |
| SCHEMBL7749384 | 0.88 | KCNN4 (0.41) | ALDH1A1HSD17B10CASP1KCNN4ESR1 | |
| SCHEMBL7749357 | 0.85 | MAPT (0.35) | SMN1; SMN2ALDH1A1HSD17B10CASP1MEN1 | |
| SCHEMBL7750624 | 0.84 | SMN1; SMN2 (0.36) | SMN1; SMN2ALDH1A1HSD17B10CASP1POLB | |
| SCHEMBL11826001 | 0.84 | CASP1 (0.47) | ALDH1A1HSD17B10CASP1KDM4ELMNA | |
| SCHEMBL4439878 | 0.83 | MEN1 (0.36) | SMN1; SMN2ALDH1A1HSD17B10POLBMEN1 | |
| SCHEMBL4431094 | 0.83 | KYAT1 (0.40) | SMN1; SMN2ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL734031 | 0.83 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1POLBMEN1KMT2A | |
| SCHEMBL6997987 | 0.83 | MAPT (0.36) | ALDH1A1HSD17B10KCNN4KDM4EALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-6242607-B1 | SUCH AS 4-CYANO-4-(3,4-DICHLOROPHENYL)HEPTANEDIOIC ACID USED AS ANTAGONISTS OF NEUROKININES | SANOFI-SYNTHELABO (FR) | 2001-06-05 | — | — | US | disclosed |
| US-6008360-A | Substituted 3-aryl-3-carboxyalkyl glutaramides, method for preparing same by 4-arylo-4-cyanoheptane dicarboxylic acid cyclisation, and use thereof for preparing 3-aryl-3-hydroxyalkylpiperidines | SANOFI-SYNTHELABO (FR) | 1999-12-28 | — | — | US | disclosed |