Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9879547 | 0.81 | CYP3A4 (0.43) | ALDH1A1TSHRRAB9ANPSR1MAPT | |
| SCHEMBL9879148 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRRAB9ANPSR1MAPT | |
| SCHEMBL4726276 | 0.79 | CYP1A2 (0.68) | ALDH1A1CYP1A2TSHRL3MBTL1KMT2A | |
| SCHEMBL4726270 | 0.79 | CYP1A2 (0.68) | ALDH1A1CYP1A2TSHRL3MBTL1KMT2A | |
| SCHEMBL7723386 | 0.78 | CYP1A2 (0.58) | ALDH1A1CYP1A2TSHRL3MBTL1NPSR1 | |
| SCHEMBL7731632 | 0.78 | CYP1A2 (0.55) | ALDH1A1CYP1A2TSHRL3MBTL1CYP3A4 | |
| SCHEMBL28235232 | 0.76 | CYP2C19 (0.49) | ALDH1A1CYP1A2TSHRLMNACYP3A4 | |
| SCHEMBL6891792 | 0.76 | ALDH1A1 (0.62) | ALDH1A1CYP1A2TSHRRAB9ANPSR1 | |
| SCHEMBL11372295 | 0.76 | ALDH1A1 (0.51) | ALDH1A1CYP1A2TSHRRAB9AL3MBTL1 | |
| SCHEMBL14463393 | 0.74 | ALDH1A1 (0.46) | ALDH1A1CYP1A2TSHRRAB9AL3MBTL1 |
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-5008285-A | Antiarthritic agent with low gastric irritability side effect | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1991-04-16 | — | — | US | disclosed |
| EP-0159684-B1 | (6,11-DIHYDRO-11-OXODIBENZ(B,E)OXEPINYL)PENTANOIC ACIDS AND DERIVATIVES, A PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1989-09-27 | — | — | EP | disclosed |
| EP-0159684-A2 | (6,11-Dihydro-11-oxodibenz(b,e)oxepinyl)pentanoic acids and derivatives, a process and intermediates for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1985-10-30 | — | — | EP | disclosed |