SCHEMBL5408265

SCHEMBL5408265

C=C(OC(C)=O)C(=O)OCCOCC

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.67
ALDH1A1 P00352 8/20 0.59
TSHR P16473 7/20 0.59
HSD17B10 Q99714 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
SOAT1 P35610 1/20 0.31
EPHX2 P34913 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL16708651 0.85 THRB (0.61) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL5027284 0.82 TSHR (0.46) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL130079 0.82 THRB (0.68) THRBALDH1A1TSHRHSD17B10LMNA
SCHEMBL16708652 0.82 THRB (0.57) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL3137530 0.82 ALDH1A1 (0.50) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL15642200 0.81 ALDH1A1 (0.63) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL36524 0.80 THRB (1.00) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL27685120 0.79 THRB (0.63) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL5411939 0.79 ALDH1A1 (0.57) THRBALDH1A1TSHRHSD17B10TDP1
SCHEMBL28167055 0.79 THRB (0.63) THRBALDH1A1TSHRHSD17B10LMNA

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-7230062-B2 Acrylic copolymer KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2007-06-12 US disclosed
US-20050182224-A1 Acrylic copolymer KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2005-08-18 US disclosed