Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 9/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.34 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAP3K5 | Q99683 | 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 | |
|---|---|---|---|---|
| SCHEMBL28858824 | 0.83 | NOTUM (0.49) | ALDH1A1NOTUMKEAP1MEN1KMT2A | |
| SCHEMBL18367778 | 0.78 | NOTUM (0.41) | ALDH1A1TSHRNOTUMHCRTR1HCRTR2 | |
| SCHEMBL3388189 | 0.76 | NOTUM (0.47) | NOTUMHCRTR1HCRTR2KEAP1 | |
| SCHEMBL6428991 | 0.76 | NOTUM (0.44) | TSHRNOTUMHCRTR1HCRTR2KEAP1 | |
| SCHEMBL27883266 | 0.75 | HCRTR1 (0.54) | ALDH1A1NOTUMHCRTR1HCRTR2KEAP1 | |
| SCHEMBL1586907 | 0.74 | HCRTR1 (0.53) | ALDH1A1NOTUMHCRTR1HCRTR2MEN1 | |
| SCHEMBL14939847 | 0.73 | ALDH1A1 (0.48) | ALDH1A1TSHRHCRTR1HCRTR2TRIM24 | |
| SCHEMBL2854803 | 0.73 | NOTUM (0.42) | ALDH1A1TSHRNOTUMHCRTR1HCRTR2 | |
| SCHEMBL17910085 | 0.73 | HCRTR1 (0.52) | NOTUMHCRTR1HCRTR2KEAP1TDP1 | |
| SCHEMBL1586174 | 0.72 | TSHR (0.43) | ALDH1A1TSHRNOTUMHCRTR1HCRTR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102781942-B | Octahydro pyrrolo-[3,4-c] pyrroles is replaced as two of orexin receptor modulators | JANSSEN PHARMACEUTICA N.V. (BE) | 2015-09-23 | — | — | CN | claimed |
| CN-102781942-A | Disubstituted octahy-dropyrrolo [3,4-c]pyrroles as orexin receptor modulators | JANSSEN PHARMACEUTICA NV | 2012-11-14 | — | — | CN | claimed |
| CN-102781942-B | Octahydro pyrrolo-[3,4-c] pyrroles is replaced as two of orexin receptor modulators | JANSSEN PHARMACEUTICA N.V. (BE) | 2015-09-23 | — | — | CN | disclosed |
| CN-102781942-A | Disubstituted octahy-dropyrrolo [3,4-c]pyrroles as orexin receptor modulators | JANSSEN PHARMACEUTICA NV | 2012-11-14 | — | — | CN | disclosed |