SCHEMBL372589

SCHEMBL372589

C=CC(=O)OCCOc1ccc(S(=O)(=O)c2ccc(OCCOC(=O)C=C)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.67
ALDH1A1 P00352 7/20 0.50
GAA P10253 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TSHR P16473 6/20 0.46
TP53 P04637 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 1/20 0.46
HPGD P15428 1/20 0.42
CYP3A4 P08684 1/20 0.42
PKM P14618 3/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA7 P43166 3/20 0.41
CA9 Q16790 3/20 0.41
CYP2D6 P10635 1/20 0.40
CYP19A1 P11511 1/20 0.40

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
SCHEMBL372590 1.00 THRB (0.67) THRBALDH1A1GAANPSR1TSHR
SCHEMBL9418506 0.96 THRB (0.61) THRBALDH1A1GAANPSR1TSHR
SCHEMBL372731 0.92 THRB (0.56) THRBALDH1A1GAANPSR1TSHR
SCHEMBL372732 0.92 THRB (0.56) THRBALDH1A1GAANPSR1TSHR
SCHEMBL9489063 0.88 THRB (0.83) THRBALDH1A1TSHRTP53HIF1A
SCHEMBL9317811 0.88 THRB (0.64) THRBALDH1A1GAANPSR1CA12
SCHEMBL9317806 0.88 THRB (0.64) THRBALDH1A1GAANPSR1CA12
SCHEMBL15353400 0.88 THRB (0.63) THRBALDH1A1GAANPSR1TSHR
SCHEMBL12769636 0.87 THRB (0.52) THRBALDH1A1GAANPSR1PKM
SCHEMBL9317373 0.87 THRB (0.63) THRBALDH1A1GAANPSR1PKM

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012010665-A2 COMBINATION OF A LUMINESCENCE SUBSTANCE WITH A HOLOGRAM SONY DADC AUSTRIA AG (AT) 2012-01-26 WO disclosed
EP-2409849-A1 Combination of a luminescent material with a hologram Sony DADC Austria AG (AT) 2012-01-25 EP disclosed
US-5702846-A COMPRISING CATIONIC POLYMERIZABLE COMPOUND, RADICAL POLYMERIZABLE COMPOUND, INITIATORS FOR BOTH, WHEREIN AT LEAST ONE POLYMERIZABLE COMPOUND CONTAINS SILOXANE GROUP NIPPON PAINT CO. LTD. (JP) 1997-12-30 US disclosed