SCHEMBL7057679

SCHEMBL7057679

Cc1c(OC(=O)Nc2ccc(N3CCC(N4CCOCC4)CC3)c(C#N)c2)cnn1-c1ccc2c(c1)OCO2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
ALDH1A1 P00352 4/20 0.47
NPSR1 Q6W5P4 3/20 0.47
RXFP1 Q9HBX9 3/20 0.47
MAPT P10636 13/20 0.39
POLB P06746 3/20 0.39
HPGD P15428 3/20 0.38
HSD17B10 Q99714 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TP53 P04637 3/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
STING1 Q86WV6 1/20 0.36
THRB P10828 1/20 0.36
USP2 O75604 1/20 0.36
ALOX15 P16050 1/20 0.36
JAK2 O60674 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
SCHEMBL7058602 0.94 MEN1 (0.49) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7050099 0.90 ALDH1A1 (0.41) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7059006 0.89 ALDH1A1 (0.39) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7058698 0.89 MAPT (0.42) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7060834 0.89 MAPT (0.39) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7054997 0.89 ALDH1A1 (0.40) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL6052235 0.89 MEN1 (0.51) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7054601 0.89 MCHR1 (0.43) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7060964 0.89 ALDH1A1 (0.44) MEN1KMT2AALDH1A1NPSR1RXFP1
SCHEMBL7057946 0.89 ALDH1A1 (0.40) MEN1KMT2AALDH1A1NPSR1RXFP1

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