Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 4/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 3/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10153468 | 0.96 | SMPD1 (0.37) | SMPD1ESR1THRBMEN1KMT2A | |
| SCHEMBL10153459 | 0.95 | ESR1 (0.39) | ESR1THRBMEN1KMT2ATHRA | |
| SCHEMBL10153467 | 0.95 | ESR1 (0.39) | ESR1THRBMEN1KMT2ATHRA | |
| SCHEMBL862834 | 0.93 | SMPD1 (0.40) | SMPD1ESR1THRBTHRAHMGCR | |
| SCHEMBL862614 | 0.90 | ESR1 (0.42) | ESR1THRBMEN1KMT2ATHRA | |
| SCHEMBL862619 | 0.89 | SMPD1 (0.41) | SMPD1ESR1THRBTHRAPDE4B | |
| SCHEMBL10153553 | 0.88 | ESR1 (0.38) | SMPD1ESR1THRBTHRAS1PR5 | |
| SCHEMBL862517 | 0.87 | ESR1 (0.43) | ESR1THRBMEN1KMT2ATHRA | |
| SCHEMBL12252238 | 0.87 | ESR1 (0.43) | ESR1THRBMEN1KMT2ATHRA | |
| SCHEMBL10153560 | 0.86 | ESR1 (0.34) | ESR1THRBMEN1KMT2ATHRA |
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 |
|---|---|---|---|---|---|---|---|
| US-20120008068-A1 | POLYMER COMPOUND AND POLYMER LIGHT-EMITTING DEVICE USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-01-12 | — | — | US | disclosed |