SCHEMBL8836029

SCHEMBL8836029

C=C(C)C(=O)Oc1ccc(/C=C/c2ccc(OC(=O)C(=C)C)cc2CCCC)c(CCCC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.40
THRB P10828 4/20 0.38
ALOX5 P09917 2/20 0.38
KMT2A Q03164 2/20 0.37
ATM Q13315 1/20 0.37
THRA P10827 2/20 0.35
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
PRSS1 P07477 1/20 0.33
ACR P10323 1/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.33
ESR1 P03372 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
SCHEMBL8835835 0.92 ELANE (0.41) ELANETHRBALOX5KMT2AATM
SCHEMBL8835770 0.88 ELANE (0.44) ELANEKMT2AATMALDH1A1KDM4E
SCHEMBL10338132 0.85 MTNR1B (0.43) ELANETHRBALOX5KMT2AATM
SCHEMBL27695940 0.84 ELANE (0.41) ELANETHRBALOX5KMT2AATM
SCHEMBL2577930 0.84 THRB (0.56) THRBALOX5KMT2ATHRATSHR
SCHEMBL27695935 0.83 MTNR1B (0.42) ELANETHRBALOX5KMT2AATM
SCHEMBL22219319 0.81 ELANE (0.42) ELANETHRBALOX5KMT2AATM
SCHEMBL2583720 0.80 THRB (0.62) THRBALOX5KMT2ATHRATSHR
SCHEMBL22219333 0.79 ELANE (0.43) ELANETHRBALOX5KMT2AATM
SCHEMBL2574997 0.79 THRB (0.60) THRBALOX5KMT2ATHRATSHR

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