Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23838140 | 0.90 | NR1H2 (0.42) | KMT2AHTTLMNASMN1; SMN2MEN1 | |
| SCHEMBL20072195 | 0.90 | PTGER4 (0.44) | KMT2AHTTLMNASMN1; SMN2MEN1 | |
| SCHEMBL23838145 | 0.87 | NR1H2 (0.41) | ALDH1A1KMT2AHTTLMNASMN1; SMN2 | |
| SCHEMBL18838746 | 0.84 | NR1H2 (0.39) | ALDH1A1KMT2AKDM4EL3MBTL1HTT | |
| SCHEMBL22368344 | 0.83 | NR1H2 (0.39) | KMT2AHTTLMNASMN1; SMN2MEN1 | |
| SCHEMBL23838197 | 0.83 | NR1H2 (0.39) | KMT2AHTTLMNASMN1; SMN2MEN1 | |
| SCHEMBL20074072 | 0.82 | CYP11B2 (0.38) | MAPTNR1H2NR1H3SMOHSD11B1 | |
| SCHEMBL20071863 | 0.82 | PTGER4 (0.39) | ALDH1A1NR1H2NR1H3SMOHSD11B1 | |
| SCHEMBL23838050 | 0.81 | DRD2 (0.38) | MAPTNR1H2NR1H3SMOHSD11B1 | |
| SCHEMBL21644246 | 0.81 | NR1H2 (0.38) | KMT2AHTTLMNASMN1; SMN2MEN1 |
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-3526203-B1 | N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME (US) | 2021-09-22 | — | — | EP | disclosed |
| WO-2018068297-A1 | N-ARYL AND N-HETEROARYL PIPERIDINE DERIVATIVES AS LIVER X RECEPTOR β AGONISTS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME CORP. (US) | 2018-04-19 | — | — | WO | disclosed |