SCHEMBL4786572

SCHEMBL4786572

COc1ccc(C2CCN(C(=O)c3ccc(C)c(NC(=O)c4cc(Cl)nc(OC)c4)c3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FASN P49327 15/20 0.53
PRSS12 P56730 1/20 0.51
HSD11B1 P28845 1/20 0.46
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL4854545 0.93 FASN (0.55) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL4785982 0.88 FASN (0.58) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL16799734 0.88 FASN (0.52) FASN
SCHEMBL4784807 0.86 FASN (0.70) FASNPRSS12
SCHEMBL4909134 0.86 FASN (0.50) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL4736480 0.85 FASN (0.68) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL4735855 0.85 FASN (0.57) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL4735653 0.84 HSD11B1 (0.60) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL4784787 0.83 PRSS12 (0.55) FASNPRSS12HSD11B1LMNAPOLB
SCHEMBL4734917 0.82 FASN (0.55) FASNPRSS12HSD11B1LMNAPOLB

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-2008059214-A1 BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-05-22 WO disclosed