SCHEMBL14749607

SCHEMBL14749607

C=CC(=O)OCCOc1ccc(C(C)(C)c2ccc(CCOC(=O)C=C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.57
KDM4E B2RXH2 7/20 0.46
ALDH1A1 P00352 6/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
POLB P06746 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
PPARA Q07869 3/20 0.42

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
SCHEMBL14173110 0.93 THRB (0.65) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL137572 0.93 THRB (0.65) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL8626582 0.92 THRB (0.46) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL14749609 0.91 THRB (0.56) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL19770675 0.89 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL7631129 0.89 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL20394042 0.89 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL12281676 0.89 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL16804047 0.89 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL1618613 0.89 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA

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
US-20130059243-A1 PHOTORECEPTOR, COATING LIQUID FOR FORMING OUTERMOST LAYER OF PHOTORECEPTOR, AND IMAGE FORMING METHOD AND APPARATUS, AND PROCESS CARTRIDGE USING THE PHOTORECEPTOR RICOH COMPANY, LTD. (JP) 2013-03-07 US disclosed