SCHEMBL4737762

SCHEMBL4737762

COc1ccc(C2CCN(C(=O)c3ccc(C)c(NC(=O)c4ccc(-c5ccccc5)cc4)c3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.57
PRSS12 P56730 1/20 0.56
FASN P49327 9/20 0.54
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 2/20 0.50
MAPT P10636 2/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.48
HIF1A Q16665 1/20 0.48
HTR2B P41595 1/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL4735653 0.95 HSD11B1 (0.60) HSD11B1PRSS12FASNALDH1A1MEN1
SCHEMBL4735855 0.91 FASN (0.57) HSD11B1PRSS12FASNALDH1A1MEN1
SCHEMBL4736480 0.89 FASN (0.68) HSD11B1PRSS12FASNMEN1KMT2A
SCHEMBL4734917 0.88 FASN (0.55) HSD11B1PRSS12FASNALDH1A1MEN1
SCHEMBL17419326 0.88 FASN (0.54) HSD11B1PRSS12FASNMEN1KMT2A
SCHEMBL4734229 0.87 FASN (0.54) HSD11B1PRSS12FASNMEN1KMT2A
SCHEMBL4734309 0.86 FASN (0.58) HSD11B1PRSS12FASNALDH1A1MEN1
SCHEMBL4734340 0.86 FASN (0.53) HSD11B1PRSS12FASNMEN1KMT2A
SCHEMBL4784787 0.85 PRSS12 (0.55) HSD11B1PRSS12FASNALDH1A1LMNA
SCHEMBL4784416 0.85 FASN (0.63) HSD11B1PRSS12FASNALDH1A1MEN1

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