Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL1257955 | 0.85 | SMN1; SMN2 (0.66) | NQO1CYP3A4SMN1; SMN2TSHRTDP1 | |
| SCHEMBL10939841 | 0.81 | NQO1 (0.56) | NQO1CYP3A4SMN1; SMN2TSHRTDP1 | |
| SCHEMBL805161 | 0.80 | NQO1 (0.61) | NQO1TSHRTDP1MAPTNPC1 | |
| SCHEMBL11128383 | 0.79 | NQO1 (0.58) | NQO1CYP3A4SMN1; SMN2TSHRTDP1 | |
| SCHEMBL8509041 | 0.77 | NQO1 (0.56) | NQO1CYP3A4SMN1; SMN2TSHRTDP1 | |
| SCHEMBL7749333 | 0.77 | NQO1 (0.56) | NQO1CYP3A4SMN1; SMN2TSHRTDP1 | |
| SCHEMBL19232137 | 0.77 | NQO1 (0.56) | NQO1CYP3A4SMN1; SMN2TSHRTDP1 | |
| SCHEMBL8629924 | 0.76 | NQO1 (0.61) | NQO1SMN1; SMN2TSHRTDP1LTA4H | |
| SCHEMBL799636 | 0.76 | NQO1 (0.67) | NQO1SMN1; SMN2TSHRTDP1LTA4H | |
| SCHEMBL13311537 | 0.76 | NQO1 (0.67) | NQO1SMN1; SMN2TSHRTDP1LTA4H |
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-0399284-B1 | Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds | BAYER AG (DE) | 1995-08-02 | — | — | EP | disclosed |
| US-5136114-A | PROCESS FOR THE PREPARATION OF GEMINAL DIARYLALKANES, NEW GEMINAL DIARYLALKANES AND ALK(EN)YLATED AROMATIC COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |
| EP-0399284-A2 | Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |