SCHEMBL8835751

SCHEMBL8835751

C=CC(=O)Oc1ccc(/C=C/c2ccccc2CCC)c(CCC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.52
THRA P10827 1/20 0.48
PPARA Q07869 4/20 0.35
PPARG P37231 3/20 0.35
PTGER3 P43115 3/20 0.35
PTGDR Q13258 2/20 0.35
PTGER4 P35408 2/20 0.34
PTGER2 P43116 2/20 0.34
TBXA2R P21731 1/20 0.34
PTGFR P43088 1/20 0.34
PPARD Q03181 1/20 0.34
RAB9A P51151 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
PDE6D O43924 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
ALOX12 P18054 1/20 0.34

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
SCHEMBL2579016 0.93 THRB (0.59) THRBTHRAPPARAPPARGMEN1
SCHEMBL8836147 0.93 THRB (0.55) THRBTHRAPTGER3PTGDRPTGER4
SCHEMBL8835520 0.91 THRB (0.60) THRBTHRAPPARAPPARGMEN1
SCHEMBL8835769 0.90 THRB (0.62) THRBTHRAPPARAPPARGMEN1
SCHEMBL8835895 0.88 THRB (0.46) THRBTHRAPTGER3PTGDRPTGER4
SCHEMBL2577930 0.85 THRB (0.56) THRBTHRAMEN1KMT2A
SCHEMBL2583720 0.84 THRB (0.62) THRBTHRAMEN1KMT2A
SCHEMBL2583117 0.83 THRB (0.51) THRBTHRAESR1ESR2PDE6D
SCHEMBL2574997 0.83 THRB (0.60) THRBTHRAMEN1KMT2A
SCHEMBL8836305 0.79 THRB (0.50) THRBTHRAPPARAPPARGMEN1

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