SCHEMBL8093405

SCHEMBL8093405

N[C@H](C(=O)N1CC(F)C1)C1CC2CCC(C1)N2C(=O)c1ccncc1F

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.43
DPP7 Q9UHL4 8/20 0.37
KCNH2 Q12809 5/20 0.37
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 2/20 0.36
CNR2 P34972 1/20 0.35
PREP P48147 1/20 0.35
FAP Q12884 1/20 0.35

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 SCHEMBL3741707 0.94 DPP4 (0.41) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL3738668 0.80 PREP (0.37) PREPFAP
Trifluoroacetic Acid SCHEMBL3751115 0.76 DPP4 (0.46) DPP4DPP7DPP8DPP9CNR2
Trifluoroacetic Acid SCHEMBL3747052 0.76 DPP4 (0.52) DPP4
SCHEMBL8091239 0.75 DPP4 (0.35) DPP4DPP7DPP8CNR2PREP
SCHEMBL30333846 0.73 POLB (0.45) DPP4DPP7DPP8CNR2PREP
SCHEMBL3747056 0.70 DPP4 (0.34) DPP4
SCHEMBL3738694 0.67 PREP (0.38) CNR2PREPFAP
SCHEMBL3742562 0.64 DPP4 (0.39) DPP4DPP7KCNH2DPP8DPP9
SCHEMBL5491523 0.64 DPP4 (0.96) DPP4DPP7KCNH2DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338450-B2 Compounds as dipeptidyl peptidase IV (DPP IV) inhibitors LUPIN LIMITED (IN) 2012-12-25 US disclosed
US-8338450-B2 Compounds as dipeptidyl peptidase IV (DPP IV) inhibitors LUPIN LIMITED (IN) 2012-12-25 US disclosed
US-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2010-11-18 US disclosed
US-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2010-11-18 US disclosed
WO-2009037719-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS LUPIN LIMITED (IN) 2009-03-26 WO 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-20100291020-A1 NOVEL COMPOUNDS AS DIPEPTIDYL PEPTIDASE IV (DPP IV) INHIBITORS DPP4, DPP7, DPP3 DPP4 1/4885DPP7 2/4885KCNH2 3411/4885

“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.