SCHEMBL6933713

SCHEMBL6933713

COc1cc(C=CC(=O)OC([SiH3])CC(C)C(O[Si](C)(C)C)O[Si](C)(C)C)cc(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
HTR1A P08908 2/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
HPGD P15428 1/20 0.46
HTR2C P28335 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 2/20 0.45
ABCB1 P08183 9/20 0.43
ABCG2 Q9UNQ0 8/20 0.43
ABCC1 P33527 7/20 0.43
PSMB11 A5LHX3 1/20 0.43
PSMA7 O14818 1/20 0.43
PSMB1 P20618 1/20 0.43
PSMA1 P25786 1/20 0.43
PSMA2 P25787 1/20 0.43
PSMA3 P25788 1/20 0.43
PSMA4 P25789 1/20 0.43
PSMB8 P28062 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL25328794 0.75 ALOX5 (0.47) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL20335193 0.74 ALDH1A1 (0.44) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL6698837 0.74 ALDH1A1 (0.44) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL647362 0.72 ALDH1A1 (0.47) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL6697993 0.72 KDM4E (0.44) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL25328798 0.72 KDM4E (0.41) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL17947814 0.71 KDM4E (0.49) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL6701256 0.71 KDM4E (0.45) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL20335167 0.71 KDM4E (0.49) ALDH1A1KDM4EHTR1AGAAHTT
SCHEMBL21816997 0.70 ALDH1A1 (0.44) ALDH1A1KDM4EHTR1AGAAHTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1369101-A1 COSMETIC W/O/W EMULSION PREPARATION SHISEIDO COMPANY LIMITED (JP) 2003-12-10 EP disclosed