SCHEMBL14944225

SCHEMBL14944225

Cc1ccc(Cn2c(-c3ccc(Cc4ccccc4)cc3)cc(C(F)(F)F)c(C#N)c2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.53
NR1H2 P55055 3/20 0.53
NR1H3 Q13133 3/20 0.53
ALDH1A1 P00352 6/20 0.52
KDM4E B2RXH2 4/20 0.52
HPGD P15428 3/20 0.52
NPSR1 Q6W5P4 2/20 0.52
PPARG P37231 1/20 0.52
NCOA2 Q15596 1/20 0.52
NCOA1 Q15788 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
NCOA3 Q9Y6Q9 1/20 0.52
PDE1C Q14123 3/20 0.51
PDE9A O76083 1/20 0.51
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
ATM Q13315 1/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
AR P10275 3/20 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
SCHEMBL14944176 0.96 RXRA (0.56) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL14944224 0.95 RXRA (0.57) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL2265833 0.94 KDM4E (0.55) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL2263602 0.92 RXRA (0.52) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL14944222 0.89 RXRA (0.51) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL2263428 0.88 KDM4E (0.54) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL6220439 0.88 RXRA (0.48) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL2262871 0.88 RXRA (0.59) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL2262221 0.88 RXRA (0.59) RXRANR1H2NR1H3ALDH1A1KDM4E
SCHEMBL14944175 0.86 RXRA (0.57) RXRANR1H2NR1H3ALDH1A1KDM4E

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