SCHEMBL14944165

SCHEMBL14944165

Cc1cccc(OCc2cccc(-c3cc(C(F)(F)F)c(C#N)c(=O)n3Cc3ccccc3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H3 Q13133 3/20 0.49
RXRA P19793 2/20 0.49
NR1H2 P55055 2/20 0.49
AR P10275 1/20 0.42
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
PPARG P37231 1/20 0.41
NCOA2 Q15596 1/20 0.41
NCOA1 Q15788 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
XBP1 P17861 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 1/20 0.41
GRM5 P41594 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL2262192 0.96 RXRA (0.49) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2266432 0.93 RXRA (0.54) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2264071 0.91 NR1H2 (0.49) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2266370 0.91 NR1H2 (0.54) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2262033 0.89 RXRA (0.50) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2265896 0.87 NR1H2 (0.51) NR1H3RXRANR1H2KDM4EHPGD
SCHEMBL2263764 0.86 RXRA (0.61) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2260085 0.86 RXRA (0.55) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2265442 0.85 RXRA (0.51) NR1H3RXRANR1H2ARKDM4E
SCHEMBL2265446 0.85 MRGPRX4 (0.48) NR1H3RXRANR1H2ARXBP1

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
EP-1465869-B1 MODULATORS OF LXR EXELIXIS PATENT CO LLC (US) 2013-05-15 EP disclosed