SCHEMBL6136439

SCHEMBL6136439

[CH2]c1ccccc1-c1ccccc1CC(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
PDK2 Q15119 1/20 0.38
EGFR P00533 2/20 0.38
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
HSD17B10 Q99714 1/20 0.37
POLB P06746 1/20 0.37
KCNA5 P22460 1/20 0.36
CFD P00746 1/20 0.36
LMNA P02545 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 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
SCHEMBL3424982 0.86 KDM4E (0.47) KDM4ETSHREGFRCYP4F2CYP4A11
SCHEMBL6136332 0.81 DPP4 (0.46) KDM4EGAATSHRPDK2CYP4F2
SCHEMBL5099244 0.80 KMT2A (0.47) KDM4EGAATSHRPDK2CYP4F2
SCHEMBL1554320 0.80 KDM4E (0.53) KDM4ETSHREGFRCYP4F2CYP4A11
SCHEMBL7353766 0.79 KMT2A (0.51) KDM4ECYP4F2CYP4A11LMNAMTNR1A
SCHEMBL19741474 0.76 ALDH1A1 (0.47) KDM4EGAATSHRSMN1; SMN2ALDH1A1
SCHEMBL14873537 0.75 KDM4E (0.42) KDM4EGAATSHRPDK2SMN1; SMN2
SCHEMBL11972779 0.74 KDM4E (0.49) KDM4ETSHREGFRCYP4F2CYP4A11
SCHEMBL2557632 0.74 EPHX1 (0.43) KDM4ETSHRCYP4F2CYP4A11ALDH1A1
SCHEMBL6287344 0.74 MEN1 (0.45) KDM4EGAATSHRSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946499-B1 N-(ARYL/HETEROARYL/ALKYLACETYL) AMINO ACID AMIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARM INC (US) 2005-06-01 EP claimed
US-6262302-B1 ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-07-17 US claimed
US-6153652-A N-(aryl/heteroaryl/alkylacetyl) amino acid amides, pharmaceutical compositions comprising same, and methods for inhibiting β-amyloid peptide release and/or its synthesis by use of such compounds ELAN PHARMACEUTICALS, INC. (US) 2000-11-28 US claimed
EP-0946499-A1 N-(ARYL/HETEROARYL/ALKYLACETYL) AMINO ACID AMIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS Athena Neurosciences, Inc. (US) 1999-10-06 EP claimed
WO-1998022433-A1 N-(ARYL/HETEROARYL/ALKYLACETYL) AMINO ACID AMIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARMACEUTICALS, INC. (US) 1998-05-28 WO claimed
EP-0946499-B1 N-(ARYL/HETEROARYL/ALKYLACETYL) AMINO ACID AMIDES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARM INC (US) 2005-06-01 EP disclosed
US-6262302-B1 ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-07-17 US disclosed
US-6153652-A N-(aryl/heteroaryl/alkylacetyl) amino acid amides, pharmaceutical compositions comprising same, and methods for inhibiting β-amyloid peptide release and/or its synthesis by use of such compounds ELAN PHARMACEUTICALS, INC. (US) 2000-11-28 US disclosed