SCHEMBL14155673

SCHEMBL14155673

CC(C)(C)OC(=O)N1CCC(CN=C(c2ccccc2)c2ccccc2)(C(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
GPR119 Q8TDV5 1/20 0.44
TSHR P16473 2/20 0.43
ALOX15 P16050 1/20 0.43
ATM Q13315 1/20 0.43
TACR1 P25103 1/20 0.43
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ABCB1 P08183 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
STS P08842 1/20 0.40

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
SCHEMBL3494478 0.88 MEN1 (0.45) KDM4EPKMTSHRALOX15MEN1
SCHEMBL3492019 0.81 WNT3A (0.41) KDM4EPKMTSHRALOX15ATM
SCHEMBL1003119 0.79 OPRD1 (0.52) KDM4EPKMGPR119TSHRALOX15
SCHEMBL30762057 0.78 KDM4E (0.48) KDM4EPKMGPR119TSHRALOX15
SCHEMBL3494231 0.78 SYK (0.47) KDM4EPKMTACR1OPRD1OPRK1
SCHEMBL20493148 0.77 OPRD1 (0.50) GPR119TSHRALOX15ATMTACR1
SCHEMBL1446835 0.76 TACR1 (0.60) KDM4EPKMGPR119TSHRALOX15
SCHEMBL2375438 0.75 GPR119 (0.50) PKMGPR119TSHRALOX15ATM
SCHEMBL8762050 0.75 GPR119 (0.44) KDM4EPKMGPR119TSHRALOX15
SCHEMBL8202394 0.75 KDM4E (0.50) KDM4EPKMGPR119TSHRALOX15

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-2008075110-A1 SUBSTITUTED PIPERIDINES CONTAINING A HETEROARYLAMIDE OR HETEROARYLPHENYL MOIETY ASTEX THERAPEUTICS LIMITED (GB) 2008-06-26 WO disclosed