SCHEMBL5719477

SCHEMBL5719477

CC#CCn1c(N2CCN(C(=O)OC(C)(C)C)CC2)nc2c1c(=O)n(CC(=O)O)c(=O)n2C

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.52
CHRM1 P11229 2/20 0.49
GPR119 Q8TDV5 1/20 0.48
DPP9 Q86TI2 1/20 0.46

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
SCHEMBL5275990 0.91 DPP4 (0.64) DPP4GPR119
SCHEMBL5719172 0.90 DPP4 (0.53) DPP4GPR119
SCHEMBL5719153 0.89 DPP4 (0.53) DPP4CHRM1GPR119
SCHEMBL5718881 0.86 DPP4 (0.54) DPP4CHRM1
SCHEMBL5790931 0.86 L3MBTL1 (0.53) DPP4
SCHEMBL5718864 0.85 DPP4 (0.49) DPP4CHRM1GPR119DPP9
SCHEMBL6698225 0.84 DPP4 (0.51) DPP4GPR119
SCHEMBL5719456 0.82 DPP4 (0.77) DPP4CHRM1DPP9
SCHEMBL5718802 0.82 GAA (0.52) DPP4
SCHEMBL5719040 0.81 DPP4 (0.42) DPP4GPR119DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074798-B2 Xanthine derivative and DPPIV inhibitor EISAI CO., LTD (JP) 2006-07-11 US disclosed
US-20060094722-A1 Combination drug EISAI CO., LTD. (JP) 2006-05-04 US disclosed
EP-1338595-B1 Xanthine derivatives as DPP-IV inhibitors EISAI CO LTD (JP) 2006-05-03 EP disclosed
EP-1557165-A1 COMBINATION DRUG Eisai Co., Ltd. (JP) 2005-07-27 EP disclosed
US-20040082570-A1 Xanthine derivative and DPPIV inhibitor EISAI CO., LTD. (JP) 2004-04-29 US disclosed
EP-1338595-A2 Xanthine derivatives as DPP-IV inhibitors Eisai Co., Ltd. (JP) 2003-08-27 EP 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-20040082570-A1 Xanthine derivative and DPPIV inhibitor DPP4, DPP9, DPP7 DPP4 1/4885CHRM1 669/4885GPR119 15/4885
US-20060094722-A1 Combination drug DPP4, GLP1R, DPP7 DPP4 1/4885CHRM1 4756/4885GPR119 14/4885

“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.