Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | COMT | P21964 | 5/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9587035 | 0.79 | HTR6 (0.70) | GAAKDM4EALDH1A1COMTNPSR1 | |
| SCHEMBL547642 | 0.77 | NQO2 (0.55) | KDM4EALDH1A1L3MBTL1NQO2 | |
| SCHEMBL29965723 | 0.77 | NQO2 (0.55) | KDM4EALDH1A1L3MBTL1NQO2 | |
| SCHEMBL669147 | 0.77 | NQO2 (0.55) | KDM4EALDH1A1NQO2 | |
| SCHEMBL7859084 | 0.76 | NQO2 (0.50) | KDM4EALDH1A1L3MBTL1NQO2 | |
| Ammonia Solution, Strong SCHEMBL7523204 | 0.75 | NQO2 (0.53) | KDM4EALDH1A1NQO2 | |
| SCHEMBL7859087 | 0.75 | NQO2 (0.53) | KDM4EALDH1A1NQO2 | |
| SCHEMBL31060702 | 0.75 | HKDC1 (0.57) | GAAKDM4EALDH1A1COMTNPSR1 | |
| SCHEMBL8476868 | 0.75 | HKDC1 (0.54) | GAAKDM4EALDH1A1COMTL3MBTL1 | |
| SCHEMBL10817165 | 0.74 | NQO2 (0.62) | KDM4EALDH1A1L3MBTL1NQO2 |
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-0772798-A1 | SPIRO INDOLINE- 2,3']-BENZOXAZINE]-TYPE PHOTOCHROMIC COMPOUNDS CONTAINING A 6'-CYANO OR PHENYLSULPHONYL GROUP AND WITH A 7', 8'-CONDENSED BENZENE RING IN THE BENZOXAZINE RING AND USE OF SAME IN OPHTHALMIC OPTICS | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 1997-05-14 | — | — | EP | disclosed |
| WO-1996004590-A1 | SPIRO[INDOLINE-[2,3']-BENZOXAZINE]-TYPE PHOTOCHROMIC COMPOUNDS CONTAINING A 6'-CYANO OR PHENYLSULPHONYL GROUP AND WITH A 7', 8'-CONDENSED BENZENE RING IN THE BENZOXAZINE RING AND USE OF SAME IN OPHTHALMIC OPTICS | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 1996-02-15 | — | — | WO | disclosed |