SCHEMBL6689632

SCHEMBL6689632

CC(=O)Nc1cccc(CCN2CCN(c3ccc(NC(=O)C4=C(c5ccc(C)cc5)CCCC4)cc3)CC2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HTR1A P08908 6/20 0.40
DRD2 P14416 4/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
MCL1 Q07820 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
DGAT1 O75907 1/20 0.40
SLC6A4 P31645 1/20 0.39
KCNH2 Q12809 1/20 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
SCHEMBL6490476 0.93 MEN1 (0.42) MAPTKMT2ASMN1; SMN2HTTNPC1
SCHEMBL6490132 0.82 LCK (0.39) MAPTSMN1; SMN2NPC1HTR1ADRD2
SCHEMBL6492454 0.82 MAPT (0.41) MAPTKMT2ASMN1; SMN2HTTNPC1
SCHEMBL6501876 0.80 CA1 (0.42) HTR1ADRD2KDM4EALDH1A1SLC6A4
SCHEMBL6498772 0.78 MAPT (0.58) MAPTKMT2ASMN1; SMN2HTTRAB9A
SCHEMBL6502650 0.77 MAPT (0.47) MAPTKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL6503264 0.76 HTR1A (0.51) MAPTSMN1; SMN2HTTNPC1RAB9A
SCHEMBL6499900 0.75 DRD2 (0.46) MAPTKMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL6487913 0.75 CHRNB2 (0.43) KMT2ANPC1RAB9ATP53
SCHEMBL6499989 0.74 NPC1 (0.53) MAPTKMT2ASMN1; SMN2NPC1RAB9A

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
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 WO disclosed