Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | NQO1 | P15559 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.37 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 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 | |
|---|---|---|---|---|
| SCHEMBL7907962 | 0.87 | GPR84 (0.43) | GPR84NQO1FFAR1FFAR4RAB9A | |
| SCHEMBL7174589 | 0.83 | NPC1 (0.41) | GPR84RAB9AMAPTNPC1TP53 | |
| SCHEMBL8632330 | 0.82 | GPR84 (0.40) | GPR84NQO1FFAR1FFAR4RAB9A | |
| SCHEMBL8110627 | 0.80 | NQO1 (0.50) | GPR84MAOBNQO1SLC5A1SLC5A2 | |
| SCHEMBL9751747 | 0.80 | NQO1 (0.54) | NQO1CHRNA7FFAR1FFAR4RAB9A | |
| SCHEMBL9664359 | 0.77 | FFAR1 (0.51) | GPR84NQO1FFAR1L3MBTL1MAPT | |
| SCHEMBL18416779 | 0.75 | CYP17A1 (0.44) | MAOBRAB9AMAPTNPC1TP53 | |
| SCHEMBL16258034 | 0.75 | CYP17A1 (0.44) | MAOBRAB9AMAPTNPC1TP53 | |
| SCHEMBL8990694 | 0.75 | NQO1 (0.52) | MAOBNQO1CHRNA7RAB9AL3MBTL1 | |
| SCHEMBL8990660 | 0.75 | NQO1 (0.52) | MAOBNQO1CHRNA7RAB9AL3MBTL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6200654-B1 | ELECTROOPTIC DISPLAYING | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2001-03-13 | — | — | US | disclosed |
| EP-0721933-B1 | 1,4-Disubstituted 2,6-difluorobenzene compounds and liquid crystal media | MERCK PATENT GMBH (DE) | 1999-07-07 | — | — | EP | disclosed |
| EP-0462237-B1 | 1,2-DISUBSTITUTED 2,6-DIFLUOROBENZENE COMPOUNDS AND LIQUID CRYSTAL MEDIA | MERCK PATENT GMBH (DE) | 1997-03-12 | — | — | EP | disclosed |
| EP-0721933-A1 | 1,4-Disubstituted 2,6-difluorobenzene compounds and liquid crystal media | MERCK PATENT GmbH (DE) | 1996-07-17 | — | — | EP | disclosed |
| EP-0462237-A1 | 1,2-DISUBSTITUTED 2,6-DIFLUOROBENZENE COMPOUNDS AND LIQUID CRYSTAL MEDIA. | MERCK PATENT GMBH (DE) | 1991-12-27 | — | — | EP | disclosed |
| WO-1991008184-A2 | 1,2-DISUBSTITUTED 2,6-DIFLUOROBENZENE COMPOUNDS AND LIQUID CRYSTAL MEDIA | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-06-13 | — | — | WO | disclosed |