SCHEMBL14944175

SCHEMBL14944175

N#Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(=O)n2Cc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.57
NR1H2 P55055 2/20 0.57
NR1H3 Q13133 2/20 0.57
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 4/20 0.54
HPGD P15428 3/20 0.54
PPARG P37231 1/20 0.54
NCOA2 Q15596 1/20 0.54
NCOA1 Q15788 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
NCOA3 Q9Y6Q9 1/20 0.54
AR P10275 6/20 0.50
MAPT P10636 1/20 0.43
GLA P06280 1/20 0.43
GAA P10253 1/20 0.43
PDE9A O76083 1/20 0.42
PDE1C Q14123 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2262221 0.93 RXRA (0.59) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL14944224 0.91 RXRA (0.57) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL2262871 0.91 RXRA (0.59) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL14944176 0.90 RXRA (0.56) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL2261188 0.89 RXRA (0.56) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL14944245 0.88 RXRA (0.60) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL14944184 0.88 RXRA (0.55) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL14944242 0.88 RXRA (0.74) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL12390456 0.87 RXRA (0.54) RXRANR1H2NR1H3KDM4EALDH1A1
SCHEMBL2264749 0.86 RXRA (0.51) RXRANR1H2NR1H3KDM4EALDH1A1

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