SCHEMBL27712092

SCHEMBL27712092

CCCCCC(=O)c1cc(C)ccc1N(C(=O)CC(N)=O)c1nccs1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
PLA2G4A P47712 1/20 0.34
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
HDAC1 Q13547 2/20 0.33
PTPN2 P17706 2/20 0.33
PTPN1 P18031 2/20 0.33
CDC25B P30305 2/20 0.33
POLB P06746 1/20 0.33
PTPN6 P29350 1/20 0.33
PTPN11 Q06124 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 1/20 0.33
QPCT Q16769 1/20 0.32
HPGD P15428 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
SCHEMBL28766755 0.88 PLA2G4A (0.35) LMNAPLA2G4AHRH2HRH1HDAC1
SCHEMBL28766722 0.87 HDAC1 (0.37) LMNAPLA2G4AHRH2HRH1HDAC1
SCHEMBL27712075 0.83 L3MBTL1 (0.32) GAATDP1L3MBTL1HTT
SCHEMBL27692040 0.83 MAPK10 (0.36) GAATDP1L3MBTL1HTT
SCHEMBL27712138 0.81 CA2 (0.32) GAATDP1L3MBTL1HTT
SCHEMBL27691974 0.78 KDM4E (0.38) LMNAHTT
SCHEMBL27711993 0.77
SCHEMBL27712003 0.75
SCHEMBL27712241 0.75
SCHEMBL27712006 0.75 PLA2G4A (0.37) LMNAPLA2G4AHDAC1

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
CN-101130526-B Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK AS 2013-07-10 CN disclosed
CN-101130526-A Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK AS (DK) 2008-02-27 CN disclosed