Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.49 |
| ▸ | PSMB8 | P28062 | 3/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.41 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KDM5C | P41229 | 1/20 | 0.36 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.36 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.36 |
| ▸ | SPR | P35270 | 1/20 | 0.35 |
| ▸ | LGALS3 | P17931 | 2/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19132855 | 0.86 | RORC (0.50) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL19128945 | 0.84 | PSMB8 (0.40) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL19132799 | 0.84 | RORC (0.43) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL19132793 | 0.83 | RORC (0.52) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL17591926 | 0.82 | ALDH1A1 (0.50) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL892462 | 0.79 | PSMB8 (0.54) | RORCPSMB8PSMB5PSMB9ALDH1A1 | |
| SCHEMBL19128783 | 0.78 | PSMB8 (0.41) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL19132804 | 0.77 | RORC (0.49) | RORCPSMB8PSMB5PSMB9DPP4 | |
| SCHEMBL23911653 | 0.75 | KDM5C (0.49) | RORCALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL27153477 | 0.75 | KDM5C (0.51) | RORCPSMB8PSMB5PSMB9DPP4 |
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 |
|---|---|---|---|---|---|---|---|
| US-9708253-B2 | Cyclohexyl sulfone RORγ modulators | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-07-18 | — | — | US | disclosed |
| US-9708253-B2 | Cyclohexyl sulfone RORγ modulators | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-07-18 | — | — | US | disclosed |