SCHEMBL9220936

SCHEMBL9220936

CCCOCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.65
ITGB3 P05106 5/20 0.61
ITGA2B P08514 5/20 0.61
EPHX2 P34913 1/20 0.53
HDAC1 Q13547 5/20 0.53
HDAC6 Q9UBN7 5/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC9 Q9UKV0 1/20 0.53
HDAC5 Q9UQL6 1/20 0.53

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
SCHEMBL9220945 1.00 FAAH (0.65) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL8523026 0.90 FAAH (0.65) FAAHITGB3ITGA2B
SCHEMBL8465365 0.90 FAAH (0.65) FAAHITGB3ITGA2B
SCHEMBL9223275 0.89 FAAH (0.57) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL21998924 0.87 FAAH (0.81) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL22494096 0.87 FAAH (0.81) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL9506671 0.87 FAAH (0.81) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL22494097 0.87 FAAH (0.81) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL22494095 0.87 FAAH (0.81) FAAHITGB3ITGA2BEPHX2HDAC1
SCHEMBL9666114 0.87 FAAH (0.81) FAAHITGB3ITGA2BEPHX2HDAC1

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
EP-0499521-B1 Inhibitors of N-myristoyltransferase, their preparation process and pharmaceutical compositions containing them ADIR (FR) 1995-06-14 EP disclosed
EP-0499521-A1 Inhibitors of N-myristoyltransferase, their preparation process and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-08-19 EP disclosed