Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19980475 | 0.87 | CRHBP (0.37) | PDK2 | |
| SCHEMBL19980422 | 0.85 | CYP1A2 (0.41) | MAOAMAOB | |
| SCHEMBL21113542 | 0.82 | CYP11B1 (0.32) | CYP11B1CYP11B2PDK2 | |
| SCHEMBL19980424 | 0.81 | MAPK1 (0.39) | MAOAMAOBTNFPDK2 | |
| SCHEMBL19567028 | 0.81 | MAPK1 (0.39) | MAOAMAOBTNFPDK2 | |
| SCHEMBL30322774 | 0.80 | MAOA (0.47) | MAOAMAOBTNFCYP11B2PDK2 | |
| SCHEMBL19009210 | 0.80 | MAOA (0.47) | MAOAMAOBTNFCYP11B2PDK2 | |
| SCHEMBL25739621 | 0.76 | CRHBP (0.30) | — | |
| SCHEMBL25739629 | 0.76 | CRHBP (0.30) | — | |
| SCHEMBL22862795 | 0.75 | CYP11B1 (0.56) | TNFCYP11B1CYP11B2PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3512841-B1 | COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES | MERCK PATENT GMBH (DE) | 2023-04-26 | — | — | EP | disclosed |
| WO-2018050584-A1 | COMPOUNDS WITH SPIROBIFLUORENE-STRUCTURES | MERCK PATENT GMBH (DE) | 2018-03-22 | — | — | WO | disclosed |