SCHEMBL28044771

SCHEMBL28044771

C=CC(=O)OC(O)CC.O=C(O)C=CCl

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.34
TSHR P16473 3/20 0.33
HPGD P15428 1/20 0.33

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
Fumaric Acid SCHEMBL2774698 0.90 HCAR2 (0.42) HCAR2TSHRHPGD
Maleic Acid SCHEMBL28398903 0.90 HCAR2 (0.42) HCAR2TSHRHPGD
Vinyl Chloride SCHEMBL5943265 0.86 TSHR (0.39) TSHRHPGD
Acrylic Acid SCHEMBL11758386 0.86 LMNA (0.40) HCAR2TSHRHPGD
Hydrogen Peroxide SCHEMBL28304847 0.86 TSHR (0.42) HCAR2TSHRHPGD
Crotonic Acid SCHEMBL27635749 0.85 HCAR2 (0.35) HCAR2TSHRHPGD
Crotonic Acid SCHEMBL28089693 0.85 HCAR2 (0.35) HCAR2TSHRHPGD
SCHEMBL26116 0.84
SCHEMBL11193107 0.84
SCHEMBL28007379 0.84 HCAR2 (0.34) HCAR2TSHRHPGD

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-105504153-A Fluorine-containing hydrophobic-associating surface-active polyacrylamide and preparation method thereof CHANGJIANG UNIV 2016-04-20 CN claimed
CN-105504153-A Fluorine-containing hydrophobic-associating surface-active polyacrylamide and preparation method thereof CHANGJIANG UNIV 2016-04-20 CN disclosed