SCHEMBL7058698

SCHEMBL7058698

COc1ccc(-n2ncc(OC(=O)Nc3ccc(N4CCC(N5CCOCC5)CC4)c(C#N)c3)c2C)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.42
MEN1 O00255 5/20 0.42
ALDH1A1 P00352 5/20 0.42
KMT2A Q03164 5/20 0.42
HPGD P15428 4/20 0.42
HSD17B10 Q99714 3/20 0.42
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
JAK2 O60674 3/20 0.41
TBK1 Q9UHD2 3/20 0.41
USP2 O75604 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK10 P53779 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PKM P14618 1/20 0.39
EGFR P00533 3/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL7056261 0.92 MAPT (0.50) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7050099 0.91 ALDH1A1 (0.41) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7060834 0.90 MAPT (0.39) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7059006 0.90 ALDH1A1 (0.39) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7054997 0.90 ALDH1A1 (0.40) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7060964 0.90 ALDH1A1 (0.44) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7054601 0.90 MCHR1 (0.43) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7057946 0.90 ALDH1A1 (0.40) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL6052504 0.90 NPC1 (0.51) MAPTMEN1ALDH1A1KMT2AHPGD
SCHEMBL7057679 0.89 MEN1 (0.47) 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