SCHEMBL14170355

SCHEMBL14170355

CNC1CC(C)CCN(CC(C)C)C1=O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.57
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
PER2 O15055 4/20 0.32
HDAC1 Q13547 1/20 0.32
POLB P06746 1/20 0.32
BIRC2 Q13490 1/20 0.31
SHMT2 P34897 1/20 0.30
CRY2 Q49AN0 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
SCHEMBL14170234 0.88 PIK3CD (0.43) PIK3CDPER2CRY2
SCHEMBL4737501 0.85 PIK3CD (0.61) PIK3CDPIK3R1PIK3CAPER2HDAC1
SCHEMBL14170114 0.83 PIK3CD (0.34) PIK3CD
SCHEMBL14170363 0.80 FPR2 (0.34) PIK3CD
SCHEMBL14170109 0.79 PIK3CD (0.32) PIK3CDPER2
SCHEMBL14170182 0.78 PIK3CD (0.33) PIK3CD
SCHEMBL14170147 0.78 PIK3CD (0.51) PIK3CDBIRC2
SCHEMBL14170351 0.78 TLR4 (0.37) PIK3CD
SCHEMBL14170129 0.78 ACHE (0.37) PIK3CDBIRC2
SCHEMBL14170161 0.78 ACHE (0.40) PIK3CDBIRC2

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 PIK3CD 3449/4885PIK3R1 3934/4885PIK3CA 4150/4885

“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.