Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL10693113 | 0.89 | KCNH2 (0.36) | KCNH2SMN1; SMN2ALDH1A1KDM4ETDP1 | |
| SCHEMBL10690077 | 0.82 | KMT2A (0.30) | SMN1; SMN2ALDH1A1LMNACYP1A2PAX8 | |
| SCHEMBL10695710 | 0.78 | PDE10A (0.39) | SMN1; SMN2ALDH1A1LMNACYP1A2NPC1 | |
| SCHEMBL10695942 | 0.77 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1LMNACYP1A2PAX8 | |
| SCHEMBL10690618 | 0.73 | MEN1 (0.42) | CYP1A2CYP2C19MEN1KMT2AKDM4E | |
| SCHEMBL9814421 | 0.72 | NOTUM (0.32) | — | |
| SCHEMBL10603073 | 0.72 | KCNH2 (0.38) | KCNH2SMN1; SMN2ALDH1A1KDM4ETDP1 | |
| SCHEMBL10696167 | 0.71 | PGK1 (0.32) | — | |
| SCHEMBL10694515 | 0.71 | — | — | |
| SCHEMBL10695186 | 0.70 | — | — |
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-0251012-A2 | N-sulfenyl-2-trifluoromethyl benzimidazoles | BAYER AG (DE) | 1988-01-07 | — | — | EP | disclosed |