SCHEMBL7057735

SCHEMBL7057735

Cc1c(OC(=O)Nc2ccc(N3CCN(CCO)CC3)c(C#N)c2)cnn1-c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
MEN1 O00255 4/20 0.41
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 4/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
ALOX15 P16050 2/20 0.41
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
P2RY12 Q9H244 1/20 0.40
TP53 P04637 3/20 0.40
AR P10275 1/20 0.40
DRD4 P21917 5/20 0.39
KDM4E B2RXH2 1/20 0.39
DRD2 P14416 3/20 0.39
HTR2A P28223 3/20 0.39

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
SCHEMBL7061032 0.95 DRD4 (0.41) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7057633 0.94 ALDH1A1 (0.42) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7059390 0.93 MAPT (0.39) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7057696 0.92 MAPT (0.40) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7056356 0.92 DRD4 (0.46) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7059077 0.92 ALDH1A1 (0.41) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7114435 0.90 AR (0.43) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7058704 0.89 MAPT (0.39) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7058465 0.89 ALDH1A1 (0.43) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7054702 0.88 MAPT (0.39) MAPTMEN1ALDH1A1KMT2AHPGD

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