SCHEMBL2597062

SCHEMBL2597062

CS(=O)(=O)c1ccc(N[C@@H]2CN(c3cnc(C(F)(F)F)nc3)CCC2N2CCCC2=O)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.38
GPR119 Q8TDV5 7/20 0.37
NR1H2 P55055 9/20 0.36
NR1H3 Q13133 8/20 0.36
KCNH2 Q12809 1/20 0.35
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 0.34
MOGAT2 Q3SYC2 2/20 0.34

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
SCHEMBL2597413 0.82 GPR119 (0.41) GPR119KCNH2CCNA2CDK2CDK5
SCHEMBL2597224 0.81 DPP4 (0.37) SLC6A9GPR119NR1H2NR1H3KCNH2
SCHEMBL2597061 0.76 SLC6A9 (0.42) SLC6A9GPR119KCNH2CCNA2CDK2
SCHEMBL2597056 0.76 SLC6A9 (0.42) SLC6A9GPR119KCNH2CCNA2CDK2
SCHEMBL789216 0.75 SLC6A9 (0.34) SLC6A9GPR119CCNA2CDK2CDK5
SCHEMBL2597109 0.72 SLC6A9 (0.37) SLC6A9GPR119CCNA2CDK2CDK5
SCHEMBL790391 0.67 BRD4 (0.33) GPR119CDK2
SCHEMBL15022657 0.67 GPR119 (0.50) SLC6A9GPR119KCNH2
SCHEMBL15022672 0.66 SLC6A9 (0.45) SLC6A9GPR119NR1H2NR1H3KCNH2
SCHEMBL14932759 0.65 GPR119 (0.36) GPR119NR1H2NR1H3CCNA2CDK2

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