SCHEMBL4533099

SCHEMBL4533099

CC(C)(C)OC(=O)N1CCC(C2OCc3cc(-c4ccc(C(=O)NCCO)cc4)ccc3O2)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.47
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
HDAC4 P56524 1/20 0.41
CD274 Q9NZQ7 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC1 Q13547 1/20 0.39
P2RY14 Q15391 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38

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
SCHEMBL4532545 0.95 GPR119 (0.46) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4529951 0.93 GPR119 (0.46) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4347832 0.92 GPR119 (0.56) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4362305 0.91 GPR119 (0.44) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4358687 0.90 SMN1; SMN2 (0.46) KDM4ERAB9A
SCHEMBL4356930 0.89 HDAC4 (0.50) GPR119PTPN2PTPN1PTPN6HDAC4
SCHEMBL4353589 0.89 PTPN2 (0.48) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4531644 0.89 GPR119 (0.47) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4351363 0.89 GPR119 (0.46) GPR119PTPN2PTPN1PTPN6KDM4E
SCHEMBL4352809 0.89 GPR119 (0.46) GPR119PTPN2PTPN1PTPN6KDM4E

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