SCHEMBL17634278

SCHEMBL17634278

CCOC(=O)CNc1cc(Cl)c(Cl)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 3/20 0.45
TSHR P16473 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.42
GAA P10253 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL16122661 0.90 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16122825 0.89 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16122580 0.89 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16121830 0.87 ALDH1A1 (0.42) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16094150 0.84 KRAS (0.40) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16122832 0.84 L3MBTL1 (0.46) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL25930508 0.83 L3MBTL1 (0.48) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL24460021 0.83 ALDH1A1 (0.56) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL16122493 0.82 L3MBTL1 (0.47) ALDH1A1KDM4EMEN1KMT2AL3MBTL1
SCHEMBL16122828 0.82 HTT (0.50) ALDH1A1KDM4EMEN1KMT2AL3MBTL1

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
WO-2016049565-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS ARAXES PHARMA LLC (US) 2016-03-31 WO disclosed
WO-2016049565-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF RAS ARAXES PHARMA LLC (US) 2016-03-31 WO disclosed