Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 5/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.31 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ASPH | Q12797 | 1/20 | 0.30 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL170373 | 0.85 | SLC6A4 (0.34) | NR1I2KCNH2GRM2CSF1RBRD4 | |
| SCHEMBL18900959 | 0.85 | SLC6A4 (0.34) | NR1I2KCNH2GRM2CSF1RBRD4 | |
| SCHEMBL9419306 | 0.83 | ESR2 (0.34) | NOTUM | |
| SCHEMBL9419303 | 0.81 | ESR2 (0.33) | NOTUM | |
| SCHEMBL9419250 | 0.80 | AR (0.33) | NR1I2KCNH2GRM2 | |
| SCHEMBL9419392 | 0.78 | RARB (0.34) | — | |
| SCHEMBL172342 | 0.78 | SLC6A4 (0.31) | NR1I2KCNH2GRM2 | |
| SCHEMBL12733559 | 0.77 | NR1I2 (0.31) | NR1I2KCNH2GRM2 | |
| SCHEMBL9419284 | 0.77 | RARB (0.36) | — | |
| SCHEMBL17359283 | 0.74 | SLC6A4 (0.32) | NR1I2KCNH2GRM2 |
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-0363458-B1 | 2,3-DIFLUOROBENZENES | MERCK PATENT GMBH (DE) | 1994-08-03 | — | — | EP | disclosed |
| US-5087764-A | Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile | Merck Patent Gesellschaft mit beschrankter Hafung (DE) | 1992-02-11 | — | — | US | disclosed |