SCHEMBL13780562

SCHEMBL13780562

CC(C)(C)OC(=O)NC1CCN(c2cc(NCc3ccc(Cl)cc3Cl)n3nccc3n2)C1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.61
SUV39H2 Q9H5I1 11/20 0.44
BTK Q06187 2/20 0.42
JAK3 P52333 1/20 0.42
KDM4D Q6B0I6 1/20 0.41

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
SCHEMBL13780241 1.00 DPP4 (0.61) DPP4SUV39H2BTKJAK3KDM4D
SCHEMBL13780243 0.85 DPP4 (0.66) DPP4
SCHEMBL14844307 0.85 DPP4 (0.61) DPP4
SCHEMBL13778043 0.83 DPP4 (0.45) DPP4SUV39H2KDM4D
SCHEMBL14413658 0.83 PDE10A (0.47) SUV39H2BTKJAK3KDM4D
SCHEMBL13780242 0.80 DPP4 (0.90) DPP4
SCHEMBL13780276 0.79 DPP4 (0.68) DPP4
SCHEMBL14051081 0.79 BTK (0.49) SUV39H2BTKJAK3
SCHEMBL4201874 0.78 DPP4 (0.57) DPP4
SCHEMBL13780009 0.78 DPP4 (0.57) DPP4

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-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 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-20090182140-A1 Alicyclic Heterocyclic Compound CCR4, CCR1, HRH4 DPP4 641/4885SUV39H2 489/4885BTK 942/4885

“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.