SCHEMBL8360501

SCHEMBL8360501

CN(CCC[C@H](N)C(=O)N1CCSC1)Cc1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.50
DPP7 Q9UHL4 11/20 0.49
DPP8 Q6V1X1 2/20 0.47
DPP9 Q86TI2 2/20 0.47
KCNH2 Q12809 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
PREP P48147 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL8361951 0.80 DPP4 (0.65) DPP4DPP7DPP8DPP9
Hydrochloric Acid SCHEMBL4911278 0.79 DPP4 (0.64) DPP4DPP7DPP8DPP9
SCHEMBL11932504 0.70 CYP2D6 (0.65) KCNH2NPSR1CYP1A2CYP2D6CYP2C19
SCHEMBL11887346 0.69 CYP2D6 (0.79) KCNH2NPSR1CYP1A2CYP2D6CYP2C19
SCHEMBL2859526 0.69 DPP4 (0.50) DPP4DPP7DPP8DPP9
SCHEMBL2859518 0.69 DPP4 (0.50) DPP4DPP7DPP8DPP9
SCHEMBL28293514 0.69 CYP2D6 (0.51) KCNH2CYP1A2CYP2D6CYP2C19
SCHEMBL7300452 0.67 DPP4 (0.62) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL7291392 0.67 DPP4 (0.62) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL14523897 0.67 DPP4 (1.00) DPP4DPP7DPP8DPP9

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-20080255126-A1 Inhibitors of post-proline cleaving proteases FERRING B.V. 2008-10-16 US disclosed
US-20080255126-A1 Inhibitors of post-proline cleaving proteases FERRING B.V. 2008-10-16 US disclosed
US-7335677-B2 Inhibitors of dipeptidyl peptidase IV FERRING B.V. (NL) 2008-02-26 US disclosed
US-7335677-B2 Inhibitors of dipeptidyl peptidase IV FERRING B.V. (NL) 2008-02-26 US disclosed
WO-2003035057-A1 INHIBITORS OF DIPEPTIDYL PEPTIDASE IV FERRING B.V. (NL) 2003-05-01 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-20080255126-A1 Inhibitors of post-proline cleaving proteases PREP, PEPD, DPP4 DPP4 3/4885DPP7 7/4885DPP8 16/4885

“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.