SCHEMBL4355344

SCHEMBL4355344

CN1CCN(C(=O)c2ccc(-c3ccc4c(c3)COC(C3CCN(C(=O)OC(C)(C)C)CC3)O4)cn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.43
TP53 P04637 3/20 0.43
SCD5 Q86SK9 1/20 0.43
THRB P10828 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
LMNA P02545 1/20 0.40
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
DYRK2 Q92630 1/20 0.39
USP30 Q70CQ3 1/20 0.39
TNKS O95271 3/20 0.38
CFTR P13569 1/20 0.37

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
SCHEMBL4521195 0.93 GPR119 (0.42) GPR119SCD5LMNAPTPN2PTPN1
SCHEMBL13586038 0.90 GPR119 (0.54) GPR119PTPN2PTPN1PTPN6USP30
SCHEMBL4348683 0.89 TNKS (0.41) LMNATNKS
SCHEMBL4355330 0.89 GPR119 (0.39) GPR119TNKS
SCHEMBL4538191 0.88 TNKS (0.41) GPR119SCD5TNKS
SCHEMBL13586034 0.88 ABL1 (0.46) GPR119TP53SCD5THRBRXFP1
SCHEMBL4354311 0.86 GPR119 (0.44) GPR119TP53THRBRXFP1LMNA
SCHEMBL4355462 0.86 POLB (0.42) PTPN2PTPN1TNKS
SCHEMBL4362448 0.86 TNKS (0.44) TNKSCFTR
SCHEMBL4349923 0.84 GPR119 (0.44) GPR119PTPN2PTPN1PTPN6USP30

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