SCHEMBL2597325

SCHEMBL2597325

CC1(C)CN(c2cnc(Cl)cn2)CCC1N1CCC(Nc2ccc(S(C)(=O)=O)cc2F)C1=O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 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
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
SLC6A9 P48067 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
SMO Q99835 2/20 0.31
ROCK2 O75116 2/20 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
SCHEMBL2597324 1.00 GPR119 (0.36) GPR119KCNH2CCNA2CDK2CDK5
SCHEMBL12186171 0.87 GPR119 (0.43) GPR119KCNH2CCNA2CDK2CDK5
SCHEMBL15022641 0.87 GPR119 (0.43) GPR119KCNH2CCNA2CDK2CDK5
SCHEMBL2599393 0.87 GPR119 (0.43) GPR119KCNH2CCNA2CDK2CDK5
SCHEMBL2597280 0.83 GPR119 (0.42) GPR119KCNH2SLC6A9
SCHEMBL2597279 0.83 GPR119 (0.42) GPR119KCNH2SLC6A9
SCHEMBL15023425 0.82 GPR119 (0.42) GPR119KCNH2
SCHEMBL15047699 0.82 GPR119 (0.42) GPR119KCNH2CCNA2CDK2CDK5
Hydrochloric Acid SCHEMBL15022769 0.81 GPR119 (0.41) GPR119KCNH2CCNA2CDK2CDK5
Hydrochloric Acid SCHEMBL15022770 0.81 GPR119 (0.41) GPR119KCNH2CCNA2CDK2CDK5

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