SCHEMBL7560442

SCHEMBL7560442

COC(OC1CN(C(=O)O)CCC1c1ccc(OCCCOC2CCCCO2)cc1)c1ccc2ccccc2c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A3 Q01959 2/20 0.40
KDM4C Q9H3R0 1/20 0.35
REN P00797 10/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALOX5 P09917 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
PDE4B Q07343 1/20 0.32

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
SCHEMBL7560445 1.00 MEN1 (0.43) MEN1KMT2ASLC6A3KDM4CREN
SCHEMBL7540005 0.92 MEN1 (0.43) MEN1KMT2ASLC6A3KDM4CREN
SCHEMBL6043272 0.83 REN (0.51) MEN1KMT2AREN
SCHEMBL6043267 0.83 REN (0.51) MEN1KMT2AREN
SCHEMBL7560322 0.82 REN (0.39) SLC6A3REN
SCHEMBL6042754 0.80 MEN1 (0.42) MEN1KMT2AKDM4CRENNPC1
SCHEMBL6042749 0.80 MEN1 (0.42) MEN1KMT2AKDM4CRENNPC1
SCHEMBL7562108 0.79 SLC6A4 (0.39) SLC6A3RENRAB9A
SCHEMBL7569293 0.79 TACR1 (0.41) SLC6A3
SCHEMBL7561346 0.78 SLC6A4 (0.38) SLC6A3

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
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed