SCHEMBL4733645

SCHEMBL4733645

Cc1ccc(C(=O)N2CCC(c3ccc(C(=O)N(C)Cc4ccccc4)cc3)CC2)cc1NC(=O)c1ccncc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FASN P49327 11/20 0.57
LMNA P02545 2/20 0.47
NAMPT P43490 2/20 0.46
HDAC1 Q13547 2/20 0.45
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43

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
SCHEMBL4737867 0.84 FASN (0.68) FASNLMNATP53MAPT
SCHEMBL4732391 0.81 FASN (0.67) FASNLMNANAMPTKMT2A
SCHEMBL4734375 0.81 FASN (0.66) FASNLMNA
SCHEMBL4732413 0.81 FASN (0.69) FASNLMNA
SCHEMBL4736874 0.80 FASN (0.53) FASNALDH1A1KMT2ATP53MAPT
SCHEMBL4736480 0.80 FASN (0.68) FASNLMNAKMT2AMAPT
SCHEMBL4785104 0.80 FASN (0.65) FASNLMNA
SCHEMBL4195141 0.79 FASN (0.57) FASN
SCHEMBL4732219 0.79 FASN (0.73) FASN
SCHEMBL4735662 0.78 FASN (0.59) FASNLMNANAMPTKMT2AMAPT

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