SCHEMBL5154142

SCHEMBL5154142

CCCC(F)OC(=O)NCCON

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
DPP7 Q9UHL4 2/20 0.33
EPHX1 P07099 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL4778558 0.79 FAAH (0.40) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL2309682 0.76 EGLN1 (0.41) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL1276782 0.74 DPP7 (0.45) DPP7EPHX1
SCHEMBL30823602 0.73 ACHE (0.57) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL12142879 0.72
SCHEMBL17748720 0.72 HDAC7 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HDAC7
SCHEMBL11969584 0.71 EPHX1 (0.59) ACHEEPHX1
SCHEMBL11969386 0.71 EPHX1 (0.55) ACHEEPHX1
SCHEMBL9989327 0.70 HDAC7 (0.35) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL3656532 0.70

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606283-A4 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC (US) 2007-05-23 EP disclosed
EP-1606283-A2 P38 INHIBITORS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2005-12-21 EP disclosed
WO-2004078116-A2 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA, INC. (US) 2004-09-16 WO disclosed