SCHEMBL14965997

SCHEMBL14965997

CS(=O)(=O)c1ccc(CN2C(=O)NCC2C2CCN(c3cnc(Cl)cn3)CC2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.42
KCNH2 Q12809 3/20 0.41
CYP3A4 P08684 1/20 0.41
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
MDM2 Q00987 1/20 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
SCHEMBL14966412 0.89 GPR119 (0.40) GPR119KCNH2CYP3A4
SCHEMBL14966716 0.88 GPR119 (0.36) GPR119KCNH2CYP3A4NR1H2NR1H3
SCHEMBL14966494 0.81 GPR119 (0.38) GPR119KCNH2CYP3A4
SCHEMBL14965995 0.80 GPR119 (0.44) GPR119KCNH2CYP3A4NR1H2NR1H3
SCHEMBL925798 0.71 GPR119 (0.65) GPR119KCNH2
SCHEMBL14966410 0.69 GPR119 (0.40) GPR119KCNH2
SCHEMBL14966714 0.68 GPR119 (0.35) GPR119NR1H2NR1H3
SCHEMBL2598425 0.68 GPR119 (0.42) GPR119KCNH2
SCHEMBL2599393 0.68 GPR119 (0.43) GPR119KCNH2CYP3A4
SCHEMBL12186171 0.68 GPR119 (0.43) GPR119KCNH2CYP3A4

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