SCHEMBL4128495

SCHEMBL4128495

CCc1nc(CC(C)(C)C)c(CNC(=O)O)c(-c2ccc(C)cc2)c1CC(=O)Nc1cccc(C(C)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 12/20 0.54
DPP9 Q86TI2 5/20 0.54
DPP8 Q6V1X1 3/20 0.45
MAPT P10636 4/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
Hydrochloric Acid SCHEMBL4123653 0.90 DPP4 (0.66) DPP4DPP9DPP8
SCHEMBL5242910 0.88 DPP4 (0.50) DPP4DPP9DPP8MAPTKDM4E
SCHEMBL4119311 0.88 DPP4 (0.54) DPP4DPP9DPP8MAPTKDM4E
Hydrochloric Acid SCHEMBL5241172 0.84 DPP4 (0.57) DPP4DPP9DPP8MAPTKDM4E
SCHEMBL4105584 0.79 DPP4 (0.63) DPP4DPP9DPP8MAPTLMNA
Hydrochloric Acid SCHEMBL4113422 0.78 DPP4 (0.67) DPP4DPP9DPP8
SCHEMBL4117724 0.76 DPP4 (0.51) DPP4DPP9DPP8MAPTKDM4E
SCHEMBL4117893 0.75 DPP4 (0.60) DPP4DPP9DPP8KDM4ELMNA
SCHEMBL4112465 0.74 DPP4 (0.68) DPP4DPP9DPP8KMT2A
SCHEMBL4112626 0.71 DPP4 (1.00) DPP4DPP9DPP8

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-20090088419-A1 PYRIDYL ACETIC ACID COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 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-20090088419-A1 PYRIDYL ACETIC ACID COMPOUNDS DPP4, GPR119, DPP3 DPP4 1/4885DPP9 11/4885DPP8 7/4885

“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.