SCHEMBL1552440

SCHEMBL1552440

C=C(C)C(=O)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.C=CCOC(=O)C=C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 1/20 0.41
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
THRB P10828 2/20 0.34
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL4884437 0.94 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL3951427 0.86 TSHR (0.40) TSHRHPGDALDH1A1CYP3A4TP53
Acrylic Acid SCHEMBL5820204 0.85 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL35807 0.85 TSHR (0.51) TSHRHPGDALDH1A1THRBPOLB
SCHEMBL333002 0.84 TSHR (0.50) TSHRHPGDALDH1A1THRBPOLB
SCHEMBL331043 0.84 TSHR (0.57) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL4883019 0.83 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL8212857 0.82 TSHR (0.57) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL395328 0.82 TSHR (0.55) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL9309438 0.82 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2112179-B1 Surface-treated powders, and cosmetics comprising the same SHISEIDO CO LTD (JP) 2011-04-27 EP disclosed
EP-1803750-B1 USE OF A POLYMER FOR SURFACE-TREATING A POWDER SHISEIDO CO LTD (JP) 2009-12-09 EP disclosed
EP-2112179-A1 Surface-treated powders, and cosmetics comprising the same Shiseido Co., Ltd. (JP) 2009-10-28 EP disclosed
EP-1803750-A1 SURFACE-TREATING AGENT, SURFACE-TREATED POWDER, AND COSMETIC PREPARATION CONTAINING SAME Shiseido Company, Limited (JP) 2007-07-04 EP disclosed