SCHEMBL2597055

SCHEMBL2597055

CC1(C)CNCCC1N1CCC(Nc2ccc(S(C)(=O)=O)cc2F)C1=O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.35
ROCK2 O75116 4/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 0.34
BDKRB1 P46663 3/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
PLAT P00750 1/20 0.32
SLC6A9 P48067 2/20 0.32
SCN8A Q9UQD0 1/20 0.31
BRD4 O60885 1/20 0.31
ROCK1 Q13464 1/20 0.31

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
SCHEMBL2597054 1.00 GPR119 (0.35) GPR119ROCK2CCNA2CDK2CDK5
SCHEMBL2597001 0.84 FPR2 (0.41) GPR119ROCK2CCNA2CDK2CDK5
SCHEMBL789215 0.84 FPR2 (0.41) GPR119ROCK2CCNA2CDK2CDK5
SCHEMBL15022867 0.81 GPR119 (0.37) GPR119CCNA2CDK2CDK5CDK5R1
SCHEMBL2597193 0.81 GPR119 (0.37) GPR119CCNA2CDK2CDK5CDK5R1
SCHEMBL2598653 0.79 BTK (0.38) GPR119PLATSLC6A9
SCHEMBL796252 0.79 BTK (0.38) GPR119PLATSLC6A9
SCHEMBL2597108 0.78 PTK6 (0.37) GPR119CCNA2CDK2CDK5CDK5R1
SCHEMBL15022863 0.78 PTK6 (0.37) GPR119CCNA2CDK2CDK5CDK5R1
Hydrochloric Acid SCHEMBL797766 0.78 BTK (0.37) GPR119PLATSLC6A9

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-2571864-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-03-27 EP disclosed
WO-2011146335-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2011-11-24 WO disclosed