SCHEMBL7679570

SCHEMBL7679570

CCCCC(NC(=O)C(C)Nc1cc(OC)cc(OC)c1)C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 5/20 0.49
TAS1R1 Q7RTX1 5/20 0.49
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.40
ERAP2 Q6P179 2/20 0.39
LNPEP Q9UIQ6 1/20 0.39
HDAC2 Q92769 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
MAPK1 P28482 1/20 0.38
BIRC2 Q13490 2/20 0.37
PDF Q9HBH1 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 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
SCHEMBL7675003 1.00 TAS1R3 (0.49) TAS1R3TAS1R1KDM4EKMT2APOLB
SCHEMBL7974014 1.00 TAS1R3 (0.49) TAS1R3TAS1R1KDM4EKMT2APOLB
SCHEMBL7674164 0.85 TAS1R3 (0.43) TAS1R3TAS1R1ERAP2LNPEPHDAC2
SCHEMBL7674167 0.85 TAS1R3 (0.43) TAS1R3TAS1R1ERAP2LNPEPHDAC2
SCHEMBL7677243 0.85 TAS1R3 (0.43) TAS1R3TAS1R1ERAP2LNPEPHDAC2
SCHEMBL8423182 0.82 TAS1R3 (0.41) TAS1R3TAS1R1KMT2AERAP2LNPEP
SCHEMBL7679340 0.80 TAS1R3 (0.51) TAS1R3TAS1R1KMT2AERAP2LNPEP
SCHEMBL7679343 0.80 TAS1R3 (0.51) TAS1R3TAS1R1KMT2AERAP2LNPEP
SCHEMBL7671377 0.80 TAS1R3 (0.51) TAS1R3TAS1R1KMT2AERAP2LNPEP
SCHEMBL7674863 0.80 TAS1R3 (0.51) TAS1R3TAS1R1KMT2AERAP2LNPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6495693-B2 TREATMENT OF ALZHEIMER'S DISEASE ATHENA NEUROSCIENCES, INC. 2002-12-17 US disclosed
US-20010020097-A1 N-(ARYL/HETEROARYL) AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS AUDIA JAMES E (US) 2001-09-06 US disclosed
US-6096782-A N-(aryl/heteroaryl) amino acid derivatives pharmaceutical compositions comprising same and methods for inhibiting β-amyloid peptide release and/or its synthesis by use of such compounds ATHENA NEUROSCIENCES, INC. (US) 2000-08-01 US disclosed
EP-0942923-A2 N-(ARYL/HETEROARYL) AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING $g(b)-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS Elan Pharmaceuticals, Inc. (US) 1999-09-22 EP disclosed
WO-1998022493-A2 N-(ARYL/HETEROARYL) AMINO ACID DERIVATIVES, 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 disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010020097-A1 N-(ARYL/HETEROARYL) AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS APP, BACE1, IAPP TAS1R3 4513/4885TAS1R1 4595/4885KDM4E 4391/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.