Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.55 |
| ▸ | RELA | Q04206 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | RARB | P10826 | 4/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | ACR | P10323 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9059113 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL16903839 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9056712 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9057046 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9462173 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9348363 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL10334287 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9056625 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9057055 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9444102 | 1.00 | NPC1 (0.55) | NPC1LMNANFKB1NFKB2RELA |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0327349-B1 | Liquid crystal compounds | SHOWA SHELL SEKIYU (JP) | 1996-04-10 | — | — | EP | claimed |
| EP-0327349-A2 | Liquid crystal compounds | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1989-08-09 | — | — | EP | claimed |
| JP-3123759-A | — | — | None | — | — | JP | disclosed |
| JP-1139551-A | — | — | None | — | — | JP | disclosed |
| EP-0327349-B1 | Liquid crystal compounds | SHOWA SHELL SEKIYU (JP) | 1996-04-10 | — | — | EP | disclosed |
| US-5424005-A | Fluoroalkyl group containing benzoic acid esters | SHOWA SHELL SEKIYU K.K. (JP) | 1995-06-13 | — | — | US | disclosed |
| JP-H03123759-A | LIQUID CRYSTAL COMPOUND | SHOWA SHELL SEKIYU KK | 1991-05-27 | — | — | JP | disclosed |
| US-4921632-A | Liquid crystal compounds and compositions | NEC CORPORATION (JP) | 1990-05-01 | — | — | US | disclosed |
| EP-0327349-A2 | Liquid crystal compounds | Showa Shell Sekiyu Kabushiki Kaisha (JP) | 1989-08-09 | — | — | EP | disclosed |
| JP-H01139551-A | LIQUID CRYSTAL COMPOUND AND COMPOSITION | SANYO CHEM IND LTD | 1989-06-01 | — | — | JP | disclosed |