Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.63 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.63 |
| ▸ | HTR3A | P46098 | 1/20 | 0.58 |
| ▸ | HRH1 | P35367 | 9/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.57 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | MC4R | P32245 | 1/20 | 0.49 |
| ▸ | PDE6D | O43924 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9535641 | 0.82 | SSTR5 (0.52) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| SCHEMBL9536849 | 0.82 | HRH1 (0.62) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| SCHEMBL9565025 | 0.78 | CYP1A2 (0.53) | KCNH2NR4A2CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL9382803 | 0.78 | KCNH2 (0.64) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| Tecastemizole SCHEMBL18200 | 0.77 | KCNH2 (1.00) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| SCHEMBL9536631 | 0.77 | SSTR5 (0.48) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| SCHEMBL9535858 | 0.77 | PKM (0.51) | KCNH2HRH1CHRM1TBXA2RCYP2D6 | |
| SCHEMBL9537373 | 0.77 | TP53 (0.52) | HRH1TBXA2RCYP2D6ALDH1A1LMNA | |
| SCHEMBL9537168 | 0.77 | SSTR5 (0.49) | KCNH2NR4A2HTR3AHRH1CHRM1 | |
| Tecastemizole SCHEMBL11278980 | 0.76 | KCNH2 (0.98) | KCNH2NR4A2HTR3AHRH1CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | disclosed |
| US-4839374-A | TREATING ALLERGIES | JANSSEN PHARMACEUTICA, N.V. (BE) | 1989-06-13 | — | — | US | disclosed |
| US-4695575-A | ANTIHISTAMINES | JANSSEN PHARMACEUTICA, N.V. (BE) | 1987-09-22 | — | — | US | disclosed |
| EP-0151826-A1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1985-08-21 | — | — | EP | disclosed |