SCHEMBL7499182

SCHEMBL7499182

CCOC(=O)C(Cc1ccccc1)NC[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
ITGA4 P13612 2/20 0.41
ITGB7 P26010 2/20 0.41
ABCB1 P08183 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
MLYCD O95822 1/20 0.39
ATM Q13315 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
NTSR1 P30989 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
CTSS P25774 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
SCHEMBL6719409 1.00 ELANE (0.41) ELANEITGA4ITGB7ABCB1L3MBTL1
SCHEMBL4444035 0.86 SIGMAR1 (0.42) ABCB1ATMKMT2AMAPK1GPR119
SCHEMBL7504062 0.80 ABCB1 (0.42) ABCB1L3MBTL1KMT2AMAPTMAPK1
SCHEMBL3614066 0.80 KEAP1 (0.41) L3MBTL1ATMKMT2AGPR119
SCHEMBL13110173 0.80 KEAP1 (0.41) L3MBTL1ATMKMT2AGPR119
SCHEMBL3614064 0.80 KEAP1 (0.41) L3MBTL1ATMKMT2AGPR119
SCHEMBL6719418 0.78 GPR119 (0.38) ATMKMT2AMAPK1GPR119
SCHEMBL2080856 0.77 HSD11B2 (0.42) ABCB1GPR119
SCHEMBL2078385 0.77 HSD11B2 (0.42) ABCB1GPR119
SCHEMBL2078387 0.77 HSD11B2 (0.42) ABCB1GPR119

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
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed