SCHEMBL14306754

SCHEMBL14306754

CCC(=O)CCc1c[nH]cn1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IAPP P10997 2/20 0.38
TDP1 Q9NUW8 1/20 0.31
MGMT P16455 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
SCHEMBL13437552 0.81 TDP1 (0.33) TDP1MGMT
SCHEMBL8227646 0.81 ALDH1A1 (0.38) IAPP
SCHEMBL18781037 0.81 TDP1 (0.33) TDP1
SCHEMBL6443420 0.79
SCHEMBL216266 0.79 FFAR1 (0.39)
SCHEMBL8448307 0.78 CYP4F2 (0.45)
SCHEMBL18402578 0.78 MAPT (0.37) TDP1
Hydrochloric Acid SCHEMBL6625511 0.78 FFAR1 (0.38)
SCHEMBL30503064 0.78
Hydrochloric Acid SCHEMBL1311654 0.78 FFAR1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080045461-A1 N-TERMINALLY MODIFIED GLP-1 RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 US disclosed
US-20070021346-A1 N-terminally modified GLP-1 receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2007-01-25 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 (2 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-20070021346-A1 N-terminally modified GLP-1 receptor modulators GLP1R, GIPR, IAPP IAPP 3/4885TDP1 2931/4885MGMT 4075/4885
US-20080045461-A1 N-TERMINALLY MODIFIED GLP-1 RECEPTOR MODULATORS GLP1R, GIPR, IAPP IAPP 3/4885TDP1 3041/4885MGMT 4157/4885

“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.