SCHEMBL19944472

SCHEMBL19944472

C=CC(=O)OC(COc1ccc(CCC)cc1)COc1ccc(CCC)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.64
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ACACB O00763 3/20 0.40
THRA P10827 1/20 0.39
HTR7 P34969 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL19944445 0.92 THRB (0.60) THRBALDH1A1KMT2AMEN1THRA
SCHEMBL13869131 0.92 THRB (0.54) THRBALDH1A1KMT2AMEN1LMNA
SCHEMBL13865583 0.89 THRB (0.52) THRBACACB
SCHEMBL19944346 0.89 THRB (0.48) THRBALDH1A1KMT2ALMNAACACB
SCHEMBL15536344 0.88 THRB (0.62) THRBALDH1A1KMT2AMEN1LMNA
SCHEMBL28695933 0.88 THRB (0.62) THRBALDH1A1KMT2AMEN1LMNA
SCHEMBL19944362 0.87 ACACB (0.46) THRBALDH1A1KMT2AMEN1LMNA
SCHEMBL19944439 0.86 ADRB2 (0.48) THRBALDH1A1KMT2AMEN1LMNA
SCHEMBL19944710 0.86 THRB (0.48) THRB
SCHEMBL28405475 0.84 THRB (0.58) THRBALDH1A1KMT2AMEN1ACACB

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-109641831-B Monomers, polymers, preparation method and use thereof 东莞东阳光医疗智能器件研发有限公司 2021-09-10 CN disclosed
WO-2018041132-A1 MONOMER, POLYMER, PREPARATION METHOD THEREFOR AND USE THEREOF 广东东阳光药业有限公司 2018-03-08 WO disclosed