Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9476334 | 1.00 | NQO1 (0.48) | NQO1TSHRTDP1RAB9ASMN1; SMN2 | |
| SCHEMBL9479520 | 0.87 | CYP3A4 (0.44) | RAB9ASMN1; SMN2KDM4ENPC1HSD17B10 | |
| SCHEMBL9476732 | 0.87 | CYP2D6 (0.51) | RAB9ASMN1; SMN2KDM4ENPC1HSD17B10 | |
| SCHEMBL9479529 | 0.87 | CYP3A4 (0.44) | RAB9ASMN1; SMN2KDM4ENPC1HSD17B10 | |
| SCHEMBL9476718 | 0.87 | CYP2D6 (0.51) | RAB9ASMN1; SMN2KDM4ENPC1HSD17B10 | |
| SCHEMBL9476615 | 0.84 | RARB (0.49) | RAB9ASMN1; SMN2NPC1LTA4HLMNA | |
| SCHEMBL9476604 | 0.84 | RARB (0.49) | RAB9ASMN1; SMN2NPC1LTA4HLMNA | |
| SCHEMBL9477453 | 0.83 | NQO1 (0.45) | NQO1TSHRTDP1RAB9ASMN1; SMN2 | |
| SCHEMBL9477467 | 0.83 | NQO1 (0.45) | NQO1TSHRTDP1RAB9ASMN1; SMN2 | |
| SCHEMBL9477491 | 0.83 | RARB (0.51) | TSHRRAB9ASMN1; SMN2NPC1TP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0377469-B1 | A LIQUID CRYSTALLINE COMPOUND | CHISSO CORPORATION (JP) | 1993-10-06 | — | — | EP | disclosed |
| US-5183587-A | LIQUID CRYSTALLINE COMPOUND | CHISSO CORPORATION (JP) | 1993-02-02 | — | — | US | disclosed |
| EP-0377469-A1 | A liquid crystalline compound | CHISSO CORPORATION (JP) | 1990-07-11 | — | — | EP | disclosed |