SCHEMBL28813009

SCHEMBL28813009

C=C(C)C(=O)OCCO.C=CC(=O)NC(C)C

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.55
THRB P10828 1/20 0.40
ALDH1A1 P00352 4/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ACACB O00763 1/20 0.31

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
Hydrochloric Acid SCHEMBL21933407 0.85 TSHR (0.51) TSHRTHRBALDH1A1GAAPOLB
SCHEMBL2148573 0.85 TSHR (0.55) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL22686669 0.84 THRB (0.64) TSHRTHRBALDH1A1GAAACACB
SCHEMBL30094953 0.84 TSHR (0.54) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL20723256 0.84 TSHR (0.50) TSHRTHRBALDH1A1GAATDP1
SCHEMBL10477338 0.83 TSHR (0.65) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL21829112 0.83 TSHR (0.63) TSHRTHRBALDH1A1GAATDP1
SCHEMBL9510240 0.82 ALDH1A1 (0.40) TSHRTHRBALDH1A1
SCHEMBL28225173 0.81 TSHR (0.43) TSHRTHRBALDH1A1POLBAPEX1
Acrylic Acid SCHEMBL6984565 0.81 TSHR (0.35) TSHRTHRBALDH1A1POLBAPEX1

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
CN-103756228-B Self-driven light modulating device and preparation method thereof HUAZHONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-01-20 CN disclosed
CN-103756228-A Self-driven dimming device and preparation method thereof UNIV HUAZHONG SCIENCE TECH 2014-04-30 CN disclosed