SCHEMBL7059006

SCHEMBL7059006

Cc1c(OC(=O)Nc2ccc(N3CCC(N4CCOCC4)CC3)c(C#N)c2)cnn1-c1ccc(F)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
HPGD P15428 4/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 3/20 0.39
HSD17B10 Q99714 3/20 0.39
KDM4E B2RXH2 1/20 0.39
JAK2 O60674 5/20 0.39
JAK1 P23458 2/20 0.39
JAK3 P52333 2/20 0.39
NPSR1 Q6W5P4 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 1/20 0.38
USP2 O75604 1/20 0.37
ALOX15 P16050 1/20 0.37
GPR6 P46095 1/20 0.36
TBK1 Q9UHD2 3/20 0.36
MCHR1 Q99705 2/20 0.36
PDE7A Q13946 1/20 0.36

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
SCHEMBL7058692 0.94 ALDH1A1 (0.41) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7057769 0.94 EGFR (0.39) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7060964 0.93 ALDH1A1 (0.44) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7054601 0.91 MCHR1 (0.43) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7050099 0.91 ALDH1A1 (0.41) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7060834 0.90 MAPT (0.39) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7058698 0.90 MAPT (0.42) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7053934 0.90 NR1H4 (0.40) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7054997 0.90 ALDH1A1 (0.40) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL7057946 0.90 ALDH1A1 (0.40) ALDH1A1HPGDMEN1KMT2AMAPT

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-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP claimed