Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL2899477 | 0.77 | KDM4E (0.33) | ALDH1A1GAAKDM4E | |
| SCHEMBL10754202 | 0.77 | KDM4E (0.33) | ALDH1A1GAAKDM4E | |
| SCHEMBL7074061 | 0.76 | ALDH1A1 (0.33) | ALDH1A1 | |
| Cyclohexane SCHEMBL4856550 | 0.74 | KDM4E (0.46) | ALDH1A1GAAKDM4E | |
| SCHEMBL11848680 | 0.74 | — | — | |
| SCHEMBL198495 | 0.73 | TSHR (0.46) | ALDH1A1 | |
| SCHEMBL11840842 | 0.73 | TSHR (0.46) | ALDH1A1 | |
| SCHEMBL11419818 | 0.72 | SLC29A1 (0.36) | ALDH1A1 | |
| SCHEMBL4734870 | 0.71 | TDP1 (0.39) | ALDH1A1 | |
| SCHEMBL11836346 | 0.71 | LTA4H (0.41) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1228070-B1 | HETEROALKYLAMINO-SUBSTITUTED BICYCLIC NITROGEN HETEROCYCLES AS INHIBITORS OF P38 PROTEIN KINASE | HOFFMANN LA ROCHE (CH) | 2007-02-07 | — | — | EP | disclosed |
| CN-1171889-C | Heteroalkylamino-substituted bicyclic nitrogen heterocycles as inhibitors of P38 protein kinase | - | 2004-10-20 | — | — | CN | disclosed |
| CN-1382144-A | Heteroalkylamino-substituted bicyclic nitrogen heterocycles as inhibitors of P38 protein kinase | HOFFMANN LA ROCHE (CH) | 2002-11-27 | — | — | CN | disclosed |
| US-6451804-B1 | Heteroalkylamino-substituted bicyclic nitrogen heterocycles | SYNTEX (U.S.A.) LLC | 2002-09-17 | — | — | US | disclosed |
| EP-1228070-A1 | HETEROALKYLAMINO-SUBSTITUTED BICYCLIC NITROGEN HETEROCYCLES AS INHIBITORS OF P38 PROTEIN KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2002-08-07 | — | — | EP | disclosed |
| WO-2001029042-A1 | HETEROALKYLAMINO-SUBSTITUTED BICYCLIC NITROGEN HETEROCYCLES AS INHIBITORS OF P38 PROTEIN KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |