SCHEMBL5772367

SCHEMBL5772367

O=C(Cn1c(=O)[nH]c(=O)c2c1nc(N1CCNCC1)n2-c1ccccc1Cl)OC(=O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.45
POLB P06746 2/20 0.39
SIRT5 Q9NXA8 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
GAA P10253 3/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TSHR P16473 3/20 0.36
ALDH1A1 P00352 3/20 0.36
HTT P42858 2/20 0.36
HSD17B10 Q99714 2/20 0.36
NPSR1 Q6W5P4 2/20 0.35
ADRB1 P08588 1/20 0.35
MAPT P10636 1/20 0.34
HTR6 P50406 1/20 0.34

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
Trifluoroacetic Acid SCHEMBL5719658 0.89 DPP4 (0.47) DPP4POLBSIRT5L3MBTL1GAA
Trifluoroacetic Acid SCHEMBL5719531 0.88 DPP4 (0.49) DPP4POLBSIRT5L3MBTL1GAA
SCHEMBL5718965 0.87 DPP4 (0.47) DPP4POLBSIRT5L3MBTL1GAA
SCHEMBL5774800 0.86 DPP4 (0.50) DPP4L3MBTL1TSHRALDH1A1NPSR1
Trifluoroacetic Acid SCHEMBL5718945 0.86 DPP4 (0.47) DPP4POLBSIRT5L3MBTL1GAA
SCHEMBL5792179 0.85 DPP4 (0.53) DPP4POLBSIRT5L3MBTL1GAA
SCHEMBL5718838 0.85 DPP4 (0.45) DPP4POLBSIRT5L3MBTL1GAA
Trifluoroacetic Acid SCHEMBL5719156 0.85 DPP4 (0.56) DPP4POLBSIRT5L3MBTL1GAA
SCHEMBL5770482 0.85 DPP4 (0.42) DPP4L3MBTL1GAAMEN1KMT2A
SCHEMBL5789315 0.85 DPP4 (0.50) DPP4POLBSIRT5L3MBTL1GAA

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-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

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-20060094722-A1 Combination drug DPP4, GLP1R, DPP7 DPP4 1/4885POLB 4529/4885SIRT5 905/4885

“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.