SCHEMBL4739741

SCHEMBL4739741

Cc1ccc(C(=O)N2CCC(c3ccc(F)cc3)CC2)cc1N(C(N)=O)C1CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.46
PARP14 Q460N5 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ATM Q13315 1/20 0.40
POLB P06746 1/20 0.40
HTR7 P34969 1/20 0.39
PDE4B Q07343 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
SLC9A1 P19634 1/20 0.39
CYP2C19 P33261 1/20 0.39
LMNA P02545 1/20 0.39
P2RY14 Q15391 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
JAK2 O60674 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
SCHEMBL4736612 0.84 GPR119 (0.51) GPR119
SCHEMBL4738385 0.84 FASN (0.48)
SCHEMBL4738617 0.79 PARP10 (0.45) PARP10PARP14NPC1RAB9AATM
SCHEMBL4194532 0.77 FASN (0.47) PARP10PARP14MEN1KMT2ANAMPT
SCHEMBL4198328 0.75 FASN (0.50)
SCHEMBL4196814 0.75 FASN (0.52)
SCHEMBL4189227 0.75 FASN (0.52)
SCHEMBL4191319 0.74 FASN (0.46) PARP10MEN1KMT2AHDAC1HDAC2
SCHEMBL2594236 0.74 NAMPT (0.60) MEN1KMT2APOLBP2RY14GPR119
SCHEMBL18805528 0.74 NAMPT (0.60) MEN1KMT2APOLBP2RY14GPR119

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-2008075064-A1 PIPERIDINE DERIVATIVES FOR THE TREATMENT OF OBESITY ASTRAZENECA AB (SE) 2008-06-26 WO disclosed