Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 8/20 | 0.41 |
| ▸ | FPR2 | P25090 | 3/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.37 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11543596 | 0.89 | HSPB1 (0.42) | LMNAHIF1AMAPTFBP1 | |
| SCHEMBL11543624 | 0.89 | FFAR1 (0.47) | ABCB11CYP1A2CYP3A4TSHRHTR2A | |
| SCHEMBL11543975 | 0.87 | HIF1A (0.46) | SCN9AFPR2PPARALMNAHIF1A | |
| SCHEMBL11507387 | 0.84 | CYP1A2 (0.50) | ABCB11CYP1A2CYP3A4TSHRHTR2A | |
| SCHEMBL11507297 | 0.84 | PARP10 (0.46) | — | |
| SCHEMBL11506945 | 0.81 | CYP2C9 (0.44) | ABCB11CYP1A2CYP3A4TSHRHTR2A | |
| SCHEMBL1349277 | 0.80 | TSHR (0.49) | ABCB11CYP1A2CYP3A4TSHRHTR2A | |
| SCHEMBL11544104 | 0.80 | SCN9A (0.41) | SCN9AFPR2PPARALMNAHIF1A | |
| SCHEMBL11506974 | 0.80 | MAPT (0.41) | SCN9AFPR2CYP1A2GAALMNA | |
| SCHEMBL11508277 | 0.79 | LPAR1 (0.42) | PPARAGAALMNAMAPTALDH1A1 |
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-4151302-A | Araliphatic dihalogen compounds composition and method of use | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-04-24 | — | — | US | disclosed |
| US-4057647-A | Araliphatic dihalogen compounds and process for their preparation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-11-08 | — | — | US | disclosed |