Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.67 |
| ▸ | CTSK | P43235 | 15/20 | 0.67 |
| ▸ | CTSL | P07711 | 2/20 | 0.49 |
| ▸ | CTSB | P07858 | 2/20 | 0.49 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8239753 | 0.85 | CTSS (0.72) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL2569628 | 0.85 | CTSS (0.49) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL12336548 | 0.84 | CTSS (0.67) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL3275039 | 0.84 | CTSS (0.67) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL15369701 | 0.82 | CTSS (0.63) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL10076131 | 0.81 | CTSS (0.67) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL9998174 | 0.81 | KMT2A (0.53) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL3145509 | 0.81 | KMT2A (0.53) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL14737659 | 0.81 | KMT2A (0.53) | CTSSCTSKCTSLCTSBCAPN1 | |
| SCHEMBL13402906 | 0.81 | CTSS (0.62) | CTSSCTSKCTSLCTSBCAPN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3508468-A1 | DEUTERATED 1-PIPERAZINO-3-PHENYL INDANES FOR TREATMENT OF SCHIZOPHRENIA | H. Lundbeck A/S (DK) | 2019-07-10 | — | — | EP | disclosed |