SCHEMBL9710906

SCHEMBL9710906

C=C(C)C(=O)OCC(C)OCC(C)OC(=O)C(=C)C.CC(O)COC(C)COC(C)CO

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.51
TDP1 Q9NUW8 1/20 0.35
THRB P10828 1/20 0.32
ALDH1A1 P00352 2/20 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
SCHEMBL14125643 1.00 TSHR (0.51) TSHRTDP1THRBALDH1A1
SCHEMBL6836450 0.97 TSHR (0.54) TSHRTDP1THRBALDH1A1
SCHEMBL11664732 0.96 TSHR (0.56) TSHRTDP1THRBALDH1A1
SCHEMBL7094773 0.90 TSHR (0.66) TSHRTDP1THRBALDH1A1
SCHEMBL863837 0.89 TSHR (0.63) TSHRTDP1THRBALDH1A1
SCHEMBL1174727 0.89 TSHR (0.63) TSHRTDP1THRBALDH1A1
SCHEMBL63227 0.89 TSHR (0.63) TSHRTDP1THRBALDH1A1
SCHEMBL2807087 0.89 TSHR (0.63) TSHRTDP1THRBALDH1A1
SCHEMBL2808626 0.89 TSHR (0.63) TSHRTDP1THRBALDH1A1
SCHEMBL9860995 0.89 TSHR (0.63) TSHRTDP1THRBALDH1A1

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
WO-1992021579-A1 MOISTURE RESISTANT GLASS CONTAINER ADVANCED GLASS TREATMENT SYSTEMS (US) 1992-12-10 WO disclosed