Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | THRA | P10827 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.44 |
| ▸ | RELA | Q04206 | 3/20 | 0.44 |
| ▸ | RARB | P10826 | 2/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | RARG | P13631 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.43 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9192300 | 1.00 | THRB (0.49) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9457709 | 0.97 | RARB (0.50) | THRBTHRASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL9406599 | 0.93 | THRB (0.50) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398594 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398285 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398299 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398370 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398290 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398597 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 | |
| SCHEMBL9398302 | 0.91 | THRB (0.42) | THRBTHRASMN1; SMN2LMNANPC1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5230827-A | DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-07-27 | — | — | US | disclosed |
| US-5198149-A | 2,3-Difluoro-p-Phenylene Group | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-03-30 | — | — | US | disclosed |
| EP-0358741-B1 | DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID | MERCK PATENT GmbH (DE) | 1993-02-10 | — | — | EP | disclosed |
| EP-0332006-B1 | SMECTIC LIQUID-CRYSTAL COMPOSITION | MERCK PATENT GmbH (DE) | 1993-01-13 | — | — | EP | disclosed |
| EP-0362317-A1 | SMECTIC LIQUID CRYSTAL MEDIUM | MERCK PATENT GmbH (DE) | 1990-04-11 | — | — | EP | disclosed |
| EP-0358741-A1 | DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID. | MERCK PATENT GMBH (DE) | 1990-03-21 | — | — | EP | disclosed |
| WO-1989008690-A1 | SMECTIC LIQUID CRYSTAL MEDIUM | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1989-09-21 | — | — | WO | disclosed |
| WO-1989008688-A1 | DERIVATIVES OF 2,3-DIFLUOROBENZOIC ACID | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1989-09-21 | — | — | WO | disclosed |
| EP-0332006-A1 | Smectic liquid-crystal composition | MERCK PATENT GmbH (DE) | 1989-09-13 | — | — | EP | disclosed |