SCHEMBL28084259

SCHEMBL28084259

CCCCCCc1ccc(NC(=O)/C=C\C(=O)O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRA P10827 4/20 1.00
THRB P10828 4/20 1.00
ATG4B Q9Y4P1 12/20 0.63
PLA2G1B P04054 10/20 0.63
CYP1A2 P05177 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
RECQL P46063 1/20 0.63
SELP P16109 1/20 0.57
S1PR1 P21453 1/20 0.56
NMT1 P30419 1/20 0.56

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
SCHEMBL9354327 1.00 THRA (1.00) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9354320 1.00 THRA (1.00) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL28084264 1.00 THRA (1.00) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL7820877 0.94 THRB (0.89) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL7820872 0.94 THRB (0.89) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL22862119 0.87 THRB (0.76) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL30189978 0.84 THRA (0.73) THRATHRBS1PR1
SCHEMBL30189994 0.84 THRA (0.73) THRATHRBS1PR1
SCHEMBL30189957 0.84 THRA (0.73) THRATHRBS1PR1
SCHEMBL2727638 0.82 THRB (1.00) THRATHRBS1PR1

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-106317310-A Acrylamide copolymer, preparation method therefor and application of acrylamide copolymer 中国石油化工股份有限公司 2017-01-11 CN disclosed
CN-104418974-B A kind of preparation method of polyacrylamide emulsion 中国石油化工股份有限公司 2016-08-17 CN disclosed