SCHEMBL5772574

SCHEMBL5772574

O=C(OC(=O)C(F)(F)F)C(CCO)n1c(=O)[nH]c(=O)c2c1nc(N1CCNCC1)n2-c1ccccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
GAA P10253 2/20 0.36
POLB P06746 2/20 0.34
SIRT5 Q9NXA8 1/20 0.34
HSD17B10 Q99714 4/20 0.32
TSHR P16473 4/20 0.32
ALDH1A1 P00352 4/20 0.32
HTT P42858 2/20 0.32
ADRB1 P08588 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
THRB P10828 1/20 0.31
PARP1 P09874 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
Trifluoroacetic Acid SCHEMBL5719191 0.89 DPP4 (0.41) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL5791981 0.87 DPP4 (0.44) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL5719200 0.87 DPP4 (0.40) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL6379680 0.82 DPP4 (0.46) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL5718955 0.82 DPP4 (0.38) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL5772367 0.82 DPP4 (0.45) DPP4MEN1KMT2AL3MBTL1GAA
Trifluoroacetic Acid SCHEMBL5718976 0.81 DPP4 (0.44) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL5718965 0.80 DPP4 (0.47) DPP4MEN1KMT2AL3MBTL1GAA
SCHEMBL5719535 0.79 DPP4 (0.40) DPP4MEN1KMT2AL3MBTL1GAA
Trifluoroacetic Acid SCHEMBL5718959 0.78 DPP4 (0.50) DPP4MEN1KMT2AL3MBTL1GAA

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-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 1/4885MEN1 1858/4885KMT2A 2689/4885

“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.