Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL11317452 | 0.87 | HTR2A (0.58) | HTR2AHRH1KDM1AUSP2ALDH1A1 | |
| SCHEMBL11251599 | 0.84 | OPRM1 (0.47) | HTR2AHRH1ALDH1A1CYP3A4CYP2C19 | |
| Bromide SCHEMBL11241487 | 0.83 | OPRM1 (0.46) | HTR2AHRH1ALDH1A1CYP3A4CYP2C19 | |
| Bromide SCHEMBL11428072 | 0.78 | HTR2A (0.42) | HTR2AHRH1USP2ALDH1A1CYP3A4 | |
| SCHEMBL11242039 | 0.77 | HRH1 (0.42) | HTR2AHRH1USP2ALDH1A1CYP3A4 | |
| SCHEMBL11253567 | 0.75 | L3MBTL1 (0.41) | HTR2AHRH1ALDH1A1MAPK1GAA | |
| Bromide SCHEMBL11253808 | 0.74 | L3MBTL1 (0.41) | HTR2AHRH1ALDH1A1MAPK1GAA | |
| Bromide SCHEMBL11441059 | 0.74 | SIGMAR1 (0.41) | HTR2AHRH1ALDH1A1HPGDKDM4E | |
| Bromide SCHEMBL11252969 | 0.74 | OPRL1 (0.48) | HTR2AHRH1 | |
| Bromide SCHEMBL11298922 | 0.73 | SIGMAR1 (0.53) | HTR2ALMNAKMT2ACYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0013424-B1 | SPIRO(DIBENZO(B,F)THIEPINE-PIPERIDINES), INTERMEDIATE PRODUCTS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-11-17 | — | — | EP | disclosed |
| EP-0013424-A1 | Spiro(dibenzo(b,f)thiepine-piperidines), intermediate products for their preparation and medicaments containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-07-23 | — | — | EP | disclosed |
| US-4198420-A | Spiro[dibenz(b,f)thiepin-piperidine]s | AMERICAN HOECHST CORPORATION (US) | 1980-04-15 | — | — | US | disclosed |