SCHEMBL4355143

SCHEMBL4355143

CN(C)C(=O)c1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)OCc4ccccc4)CC2)O3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
CYP2C19 P33261 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTT P42858 1/20 0.39
TRPC3 Q13507 2/20 0.39
TRPC7 Q9HCX4 2/20 0.39
GRIN2B Q13224 3/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
ENPP2 Q13822 1/20 0.38
USP30 Q70CQ3 1/20 0.37
PPARG P37231 1/20 0.37
CYP3A4 P08684 1/20 0.37
NPY2R P49146 1/20 0.37
PDE4B Q07343 1/20 0.36

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
SCHEMBL4352115 0.92 GPR119 (0.46) GPR119SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL4533655 0.89 SMN1; SMN2 (0.47) GPR119SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL4536272 0.88 KMT2A (0.43) GPR119SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL4526460 0.86 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9ACYP2C19MEN1
SCHEMBL4350085 0.85 SMN1; SMN2 (0.41) GPR119SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL4351624 0.85 ENPP2 (0.44) GPR119SMN1; SMN2NPC1RAB9ACYP2C19
SCHEMBL4538463 0.85 NPY2R (0.39) GPR119CYP2D6CYP2C9USP30CYP3A4
SCHEMBL4360506 0.84 GPR119 (0.47) GPR119USP30
SCHEMBL4353770 0.82 NPY2R (0.42) GPR119CYP2C9USP30CYP3A4NPY2R
SCHEMBL4360439 0.82 TSHR (0.44) GPR119MEN1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO claimed
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed