SCHEMBL13767448

SCHEMBL13767448

CCCCCCOc1ccc(C(=O)Cc2ccc(-c3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.59
RAB9A P51151 1/20 0.55
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 2/20 0.53
HTT P42858 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC2 Q92769 1/20 0.53
TSHR P16473 2/20 0.52
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
PLA2G4B P0C869 2/20 0.51
MAPT P10636 1/20 0.51
THRA P10827 2/20 0.51
THRB P10828 2/20 0.51
MMP3 P08254 1/20 0.51
MMP2 P08253 1/20 0.50

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
SCHEMBL7932134 0.84 RARB (0.62) RARBALDH1A1KDM4ETSHRTP53
SCHEMBL17225152 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL1890880 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL2955126 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL1892515 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL1893734 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL1894564 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL2463814 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL12736278 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT
SCHEMBL7183745 0.83 KDM4E (0.71) RARBALDH1A1KDM4EHPGDHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090169774-A1 Retardation film, and polarizing plate and liquid crystal display comprising the same LG CHEM, LTD. (KR) 2009-07-02 US disclosed
US-20090169774-A1 Retardation film, and polarizing plate and liquid crystal display comprising the same LG CHEM, LTD. (KR) 2009-07-02 US disclosed