SCHEMBL7673452

SCHEMBL7673452

CC(Nc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](C(N)=O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 3/20 0.46
THRB P10828 1/20 0.46
MMP8 P22894 1/20 0.42
MMP14 P50281 1/20 0.42
CA14 Q9ULX7 1/20 0.42
MAPT P10636 2/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EPHX1 P07099 1/20 0.41
EPHX2 P34913 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MCL1 Q07820 1/20 0.40
F7 P08709 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39

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
SCHEMBL7679890 1.00 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL7679892 1.00 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL7678205 0.88 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL1822434 0.88 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL1822435 0.88 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL7680305 0.88 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL1822559 0.88 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL7680271 0.85 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL1821265 0.85 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1THRBMMP8MMP14
SCHEMBL1821268 0.85 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1THRBMMP8MMP14

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 SMN1; SMN2 1398/4885ALDH1A1 3198/4885THRB 1684/4885

“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.