Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.66 |
| ▸ | RAB9A | P51151 | 6/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.66 |
| ▸ | HPGD | P15428 | 5/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | MAPT | P10636 | 1/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.66 |
| ▸ | CASP1 | P29466 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | CASP7 | P55210 | 1/20 | 0.66 |
| ▸ | ATM | Q13315 | 1/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.66 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.58 |
| ▸ | RELA | Q04206 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL10910380 | 1.00 | NPC1 (0.66) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL14407423 | 1.00 | NPC1 (0.66) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL14195802 | 0.93 | NPC1 (0.56) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL762311 | 0.89 | NR4A2 (0.62) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| Dimethylamine SCHEMBL8172161 | 0.86 | MAPK13 (0.56) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL15489590 | 0.84 | NPC1 (0.50) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL9113400 | 0.83 | MAPK14 (0.61) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL14660408 | 0.83 | NR1H4 (0.53) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL8172158 | 0.82 | NOX1 (0.52) | NPC1RAB9AKDM4EHPGDALDH1A1 | |
| SCHEMBL19700319 | 0.82 | NOX1 (0.52) | NPC1RAB9AKDM4EHPGDALDH1A1 |
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-1095937-B1 | Process for the preparation of trisubstituted oxazoles | OREAL (FR) | 2003-03-12 | — | — | EP | disclosed |
| US-6333414-B1 | BY REACTION OF THIOUREA WITH THE CORRESPONDING DIKETONE ESTER; CARRIED OUT UNDER REACTION CONDITIONS, PARTICULARLY WITH RESPECT TO PH, WHICH ARE INDUSTRIALLY MORE FAVORABLE. | L'ORéAL S.A. (FR) | 2001-12-25 | — | — | US | disclosed |
| EP-1095937-A1 | Process for the preparation of trisubstituted oxazoles | L'OREAL (FR) | 2001-05-02 | — | — | EP | disclosed |