SCHEMBL22881122

SCHEMBL22881122

C=CC(=O)N1CCN(C(C)CC)C(F)C1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
TEAD1 P28347 7/20 0.33
GPR183 P32249 1/20 0.33
TET3 O43151 1/20 0.32
KMT2A Q03164 1/20 0.32
FBXL19 Q6PCT2 1/20 0.32
CXXC5 Q7LFL8 1/20 0.32
TET1 Q8NFU7 1/20 0.32
KDM2B Q8NHM5 1/20 0.32
CXXC4 Q9H2H0 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
JAK3 P52333 8/20 0.31

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
SCHEMBL20314874 0.84 TEAD1 (0.36) TEAD1TET3KMT2AFBXL19CXXC5
SCHEMBL20314855 0.73 BTK (0.34) TEAD1JAK3
SCHEMBL23544836 0.73 JAK3 (0.41) TEAD1JAK3
SCHEMBL20314873 0.73 JAK3 (0.41) TEAD1JAK3
SCHEMBL23735765 0.73 TET3 (0.34) TEAD1TET3KMT2AFBXL19CXXC5
SCHEMBL20334399 0.73 GPR183 (0.54) TEAD1GPR183TET3KMT2AFBXL19
SCHEMBL20314921 0.72 TEAD1 (0.34) TEAD1KMT2AJAK3
SCHEMBL19353212 0.71 DPP4 (0.40) DPP4DPP8DPP9TEAD1JAK3
SCHEMBL20334389 0.71 DPP4 (0.36) DPP4TEAD1JAK3
SCHEMBL23544835 0.71 JAK3 (0.35) TEAD1KMT2AJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210009577-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME AMGEN INC. 2021-01-14 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-20210009577-A1 KRAS G12C INHIBITORS AND METHODS OF USING THE SAME KRAS, NRAS, HRAS DPP4 3354/4885DPP8 2325/4885DPP9 2414/4885

“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.