SCHEMBL3664088

SCHEMBL3664088

CCCC(F)OC(=O)N1CCC(C=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
THRB P10828 1/20 0.33
ATM Q13315 1/20 0.33
GPR119 Q8TDV5 3/20 0.32
DPP4 P27487 2/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 1/20 0.31
CTSK P43235 1/20 0.31
MDM2 Q00987 1/20 0.31
CHRM1 P11229 1/20 0.31
POLB P06746 2/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL4440022 0.84 DPP4 (0.39) GAANOS3NOS2L3MBTL1THRB
SCHEMBL4767291 0.80 CTSK (0.38) GAANOS3NOS2L3MBTL1THRB
SCHEMBL5713338 0.80 L3MBTL1 (0.38) L3MBTL1ALDH1A1KDM4ECHRM1POLB
SCHEMBL3658800 0.80 CTSK (0.34) GAAGPR119DPP8CTSK
SCHEMBL3664525 0.79 L3MBTL1 (0.40) L3MBTL1THRBATMALDH1A1KDM4E
SCHEMBL4755022 0.77 GPR119 (0.44) GPR119
SCHEMBL3636033 0.76 CA2 (0.35) ALDH1A1POLBHTTSMN1; SMN2
SCHEMBL1267031 0.75 GAA (0.59) GAANOS3NOS2L3MBTL1THRB
SCHEMBL5595638 0.75 ALDH1A1 (0.33) GAAALDH1A1POLBHTTSMN1; SMN2
SCHEMBL7488600 0.74 PRMT5 (0.38) DPP4ALDH1A1CTSKPOLBSMN1; SMN2

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-2229374-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2010-09-22 EP disclosed
WO-2009074789-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2009-06-18 WO disclosed