SCHEMBL4520212

SCHEMBL4520212

O=C(O)c1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)c4ccccc4)CC2)O3)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.47
PTPN1 P18031 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 3/20 0.43
CYP2C19 P33261 1/20 0.43
MGLL Q99685 4/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
FASN P49327 2/20 0.42
POLB P06746 1/20 0.42
HTR2B P41595 1/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 1/20 0.41
PIK3CA P42336 1/20 0.41
HSD11B1 P28845 1/20 0.41

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
SCHEMBL4355595 0.92 POLB (0.54) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL13586029 0.91 PTPN2 (0.44) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4538215 0.89 PTPN2 (0.45) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL13586060 0.89 SMN1; SMN2 (0.47) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4357579 0.89 PTPN2 (0.44) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4356473 0.88 PTPN2 (0.43) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4349922 0.88 PTPN2 (0.43) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4537918 0.88 PTPN2 (0.43) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL13586043 0.87 NPY2R (0.43) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19
SCHEMBL4530802 0.86 LMNA (0.51) PTPN2PTPN1SMN1; SMN2ALDH1A1CYP2C19

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
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