SCHEMBL8836152

SCHEMBL8836152

C=CC(=O)Oc1ccc(C(CCCC)=C(CCCC)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.56
PTGS2 P35354 8/20 0.50
THRA P10827 1/20 0.48
ESR1 P03372 2/20 0.48
ELANE P08246 2/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL8835525 0.96 THRB (0.58) THRBPTGS2THRAESR1ELANE
SCHEMBL8835771 0.95 THRB (0.57) THRBPTGS2THRAESR1CES2
SCHEMBL2577932 0.94 THRB (0.61) THRBPTGS2THRAESR1RECQL
SCHEMBL8835752 0.92 THRB (0.55) THRBPTGS2THRAESR1ELANE
SCHEMBL2583721 0.90 THRB (0.64) THRBPTGS2THRAESR1RECQL
SCHEMBL2575000 0.89 THRB (0.62) THRBPTGS2THRAESR1RECQL
SCHEMBL8835900 0.85 ESR1 (0.58) THRBPTGS2ESR1ELANERECQL
SCHEMBL2579019 0.85 THRB (0.61) THRBTHRAESR1ELANERECQL
SCHEMBL8835804 0.82 AKT1 (0.59) THRBPTGS2THRAESR1CES2
SCHEMBL10773604 0.82 PTGS2 (0.60) PTGS2ESR1KMT2A

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
US-5674576-A A LIGHT MODULATING LAYER COMPOSED OF LIQUID CRYSTAL AND HIGH POLYMER RESIN IS SANDWHICHED BETWEEN TWO SUBSTRATES HAVING ELECTRODE LAYERS, MONOMERS ARE OF(METH)ACRYLOYL COMPOUNDS WITH STIBENE OR (METH)ACRYLOYL WITH DIOXANE OR DIOXOLANES NEC CORPORATION (JP) 1997-10-07 US disclosed