SCHEMBL13435132

SCHEMBL13435132

C=CC(=O)OCCOCC(COCCOC(=O)CC)(COCCOC(=O)CC)COCCOC(=O)CC

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.73
TSHR P16473 9/20 0.56
ALDH1A1 P00352 6/20 0.56
TP53 P04637 3/20 0.56
HIF1A Q16665 3/20 0.56
HSD17B10 Q99714 1/20 0.56
HPGD P15428 1/20 0.47
CYP3A4 P08684 2/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NAAA Q02083 1/20 0.37
ATM Q13315 1/20 0.31
GAA P10253 1/20 0.30
DGKA P23743 1/20 0.30

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
SCHEMBL12452159 1.00 THRB (0.73) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL12452163 0.98 THRB (0.71) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL11896691 0.94 THRB (0.85) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL12452161 0.93 THRB (0.64) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL10314662 0.92 THRB (0.82) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL10099803 0.88 TSHR (0.73) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL14550291 0.88 TSHR (0.73) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL39953 0.88 THRB (0.79) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL12346603 0.88 THRB (0.69) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL14747687 0.87 THRB (0.64) THRBTSHRALDH1A1TP53HIF1A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8574454-B2 Patternable liquid crystal polymer comprising thio-ether units ROLIC AG (CH) 2013-11-05 US disclosed
US-20100059709-A1 PATTERNABLE LIQUID CRYSTAL POLYMER COMPRISING THIO-ETHER UNITS ROLIC AG (CH) 2010-03-11 US disclosed