SCHEMBL14978690

SCHEMBL14978690

CS(=O)(=O)c1ccc(CN2CCN(C3CCN(C(N)=O)CC3)C2=O)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.42
KCNH2 Q12809 1/20 0.42
BTK Q06187 1/20 0.36
TP53 P04637 1/20 0.36
SLC6A9 P48067 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
RORC P51449 1/20 0.35

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
SCHEMBL14966130 0.86 GPR119 (0.54) GPR119TP53
SCHEMBL14978024 0.85 TP53 (0.35) GPR119KCNH2BTKTP53
SCHEMBL16172053 0.83 TP53 (0.42) GPR119KCNH2TP53RXFP1
SCHEMBL14968960 0.82 GPR119 (0.52) GPR119TP53
Trifluoroacetic Acid SCHEMBL14966698 0.81 GPR119 (0.43) GPR119KCNH2TP53RXFP1
SCHEMBL14978750 0.79 GPR119 (0.39) GPR119KCNH2TP53RXFP1
SCHEMBL14978691 0.78 TP53 (0.37) GPR119TP53RXFP1
SCHEMBL14965995 0.77 GPR119 (0.44) GPR119KCNH2
SCHEMBL14968965 0.76 GPR119 (0.40) GPR119KCNH2TP53RXFP1
SCHEMBL14966416 0.76 KCNH2 (0.45) GPR119KCNH2SLC6A9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013074641-A1 PIPERIDINYL- SUBSTITUTED CYCLIC UREAS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2013-05-23 WO disclosed