SCHEMBL5339408

SCHEMBL5339408

CN(C)C(=O)C(=O)Nc1ccc(Cl)c(C(=O)N2CCC(Oc3ccccc3)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 3/20 0.47
CCR3 P51677 3/20 0.47
KMT2A Q03164 1/20 0.47
GRIN2D O15399 3/20 0.44
GRIN3B O60391 3/20 0.44
GRIN1 Q05586 3/20 0.44
GRIN2A Q12879 3/20 0.44
GRIN2B Q13224 3/20 0.44
GRIN2C Q14957 3/20 0.44
GRIN3A Q8TCU5 3/20 0.44
EPHX2 P34913 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2J2 P51589 1/20 0.44
SCD5 Q86SK9 1/20 0.42
PRSS12 P56730 2/20 0.42
CHRNA7 P36544 2/20 0.42
NAMPT P43490 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL14466898 0.92 GRIN2D (0.53) HRH1CCR3GRIN2DGRIN3BGRIN1
SCHEMBL14466897 0.92 EPHX2 (0.45) HRH1CCR3KMT2AGRIN2DGRIN3B
SCHEMBL14467021 0.91 EPHX2 (0.46) HRH1CCR3GRIN2DGRIN3BGRIN1
SCHEMBL14466893 0.90 HRH1 (0.52) HRH1CCR3GRIN2DGRIN3BGRIN1
SCHEMBL14467000 0.88 KMT2A (0.44) KMT2AGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14467002 0.86 EPHX2 (0.43) HRH1CCR3KMT2AEPHX2NAMPT
SCHEMBL14466997 0.84 KMT2A (0.39) HRH1CCR3KMT2AGRIN2DGRIN3B
SCHEMBL14467006 0.84 KMT2A (0.39) HRH1CCR3KMT2AGRIN2DGRIN3B
SCHEMBL14467008 0.83 GRIN2D (0.52) HRH1CCR3GRIN2DGRIN3BGRIN1
SCHEMBL14466907 0.83 MMP1 (0.43) KMT2AGRIN2DGRIN3BGRIN1GRIN2A

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
WO-2007082079-A2 PIPERIDINE AMIDE DERIVATIVES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2007-07-19 WO disclosed
WO-2007082079-A2 PIPERIDINE AMIDE DERIVATIVES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2007-07-19 WO disclosed