SCHEMBL6449835

SCHEMBL6449835

N[C@@H](CC(=O)N1Cc2ccccc2C[C@H]1COc1cccc(F)c1)Cc1ccccc1F

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.50
NR1D1 P20393 4/20 0.45
DPP7 Q9UHL4 4/20 0.45
DPP8 Q6V1X1 1/20 0.43

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
SCHEMBL5662490 0.86 DPP4 (0.49) DPP4DPP7DPP8
SCHEMBL6444430 0.84 DPP4 (0.67) DPP4DPP7DPP8
SCHEMBL6444425 0.82 DPP4 (0.40) DPP4NR1D1
SCHEMBL8282472 0.81 DPP4 (0.55) DPP4NR1D1DPP7DPP8
SCHEMBL8281247 0.79 DPP4 (0.52) DPP4DPP7DPP8
SCHEMBL8282334 0.76 DPP4 (0.54) DPP4DPP7DPP8
SCHEMBL21067940 0.76 DPP4 (0.53) DPP4DPP7DPP8
SCHEMBL21067942 0.76 DPP4 (0.53) DPP4DPP7DPP8
SCHEMBL8293182 0.76 DPP4 (0.55) DPP4DPP7DPP8
SCHEMBL5661437 0.76 DPP4 (0.53) DPP4DPP7DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
US-20070265301-A1 Dpp-IV Inhibitors SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-11-15 US disclosed
EP-1604662-A1 1-[(3R)-Amino-4-(2-fluoro-phenyl)-butyl]-pyrrolidine-(2R)-carboxylic acid benzyl amine derivatives and related compounds as dipeptidyl peptidase IV (DPP-IV) inhibitors for the treatment of type 2 diabetes mellitus Santhera Pharmaceuticals (Deutschland) Aktiengesellschaft (DE) 2005-12-14 EP disclosed
WO-2005113510-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2005-12-01 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-20070265301-A1 Dpp-IV Inhibitors DPP4, DPP8, DPP7 DPP4 1/4885NR1D1 1769/4885DPP7 3/4885

“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.