SCHEMBL14170797

SCHEMBL14170797

CNC1CSCCN(CC2CCOCC2)C1=O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP1 P29466 1/20 0.31
▸ CASP8 Q14790 1/20 0.31
▸ GRM5 P41594 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ SRC P12931 1/20 0.31
▸ CYP11B2 P19099 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TNKS2 Q9H2K2 1/20 0.30

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
SCHEMBL14170818 0.92 PIK3CA (0.35) CASP1CASP8SRCCYP11B2
SCHEMBL14170781 0.90 SRC (0.33) CASP1CASP8SRC
SCHEMBL14170779 0.88 SRC (0.32) CASP1CASP8SRC
SCHEMBL14170778 0.88 SRC (0.33) CASP1CASP8SRC
SCHEMBL14170795 0.88 FPR2 (0.33) CASP1CASP8SRC
SCHEMBL14170782 0.86 SRC (0.35) CASP1CASP8SRC
SCHEMBL14170773 0.86 SRC (0.35) CASP1CASP8SRC
SCHEMBL14170803 0.86 SRC (0.33) CASP1CASP8SRC
SCHEMBL14170801 0.85 BRD4 (0.35) BRD4SRC
SCHEMBL14170802 0.85 SRC (0.32) CASP1CASP8SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7390801-B2 Cycloalkyl, lactam, lactone and related compounds, 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) 2008-06-24 — — US disclosed
US-7390801-B2 Cycloalkyl, lactam, lactone and related compounds, 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) 2008-06-24 — — US disclosed
US-20070203108-A1 Alzheimer's disease; 5-{N'-(4-thianaphthenacetyl)-L-alaninyl}-amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one THORSETT EUGENE D 2007-08-30 — — US disclosed
US-20070203108-A1 Alzheimer's disease; 5-{N'-(4-thianaphthenacetyl)-L-alaninyl}-amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one THORSETT EUGENE D 2007-08-30 — — US 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-20070203108-A1 Alzheimer's disease; 5-{N'-(4-thianaphthenacetyl)-L-alaninyl}-amino-7-methyl-5,7-dihydro-6H-dibenz[b,d]azepin-6-one APP, BACE1, PSEN1 CASP1 3289/4885CASP8 3109/4885GRM5 364/4885

“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.

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