SCHEMBL4948965

SCHEMBL4948965

CC(C)[C@H](N)C(=O)C1(C(=O)C2(C(=O)[C@@H](N)C(C)C)CCCC2)CCCC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.39
DPP4 P27487 8/20 0.32
DPP7 Q9UHL4 6/20 0.31
FAP Q12884 4/20 0.31
DPP8 Q6V1X1 4/20 0.31
DPP9 Q86TI2 3/20 0.31
PREP P48147 2/20 0.31
PITRM1 Q5JRX3 1/20 0.31

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
SCHEMBL4952590 0.98 SLC7A5 (0.38) SLC7A5DPP4DPP7FAPDPP8
SCHEMBL4953896 0.81 DPP4 (0.41) DPP4DPP7FAPDPP8DPP9
SCHEMBL4955670 0.80 DPP4 (0.40) DPP4DPP7FAPDPP8DPP9
SCHEMBL10535530 0.71 ALDH1A1 (0.31)
SCHEMBL10535546 0.71 ALDH1A1 (0.31)
SCHEMBL24798590 0.64 SLC7A5 (0.41) SLC7A5DPP4DPP7FAPDPP8
SCHEMBL19663543 0.64 SLC7A5 (0.41) SLC7A5DPP4DPP7FAPDPP8
SCHEMBL21367436 0.64 SLC7A5 (0.41) SLC7A5DPP4DPP7FAPDPP8
SCHEMBL2632698 0.64 SLC7A5 (0.41) SLC7A5DPP4DPP7FAPDPP8
Valine SCHEMBL9318955 0.62 SLC7A5 (0.83) SLC7A5DPP4DPP7FAPDPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368576-B2 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents PROBIODRUG AG (DE) 2008-05-06 US disclosed
US-7368421-B2 Use of dipeptidyl peptidase IV inhibitors in the treatment of multiple sclerosis PROBIODRUG AG (DE) 2008-05-06 US disclosed
US-20070207946-A1 Dipeptidyl peptidase IV inhibitors and their uses for lowering blood pressure levels POSPISILIK ANDREW J 2007-09-06 US disclosed
US-20060293248-A1 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents PROBIODRUG AG 2006-12-28 US disclosed
US-7109347-B2 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents PROBIODRUG AG (DE) 2006-09-19 US disclosed
CN-1688599-A Novel use of dipeptidyl peptidase IV inhibitor PROBIODRUG AG (DE) 2005-10-26 CN disclosed
US-20050171025-A1 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents PROBIODRUG AG (DE) 2005-08-04 US disclosed
US-20050107308-A1 Dipeptidyl peptidase IV inhibitors and their uses for lowering blood pressure levels PROSIDION LIMITED (GB) 2005-05-19 US disclosed
CN-1464881-A New dipeptidyl peptidase iv inhibitors and their uses as anti-cancer agents PROBIODRUG AG (CN) 2003-12-31 CN 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 (4 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-20050107308-A1 Dipeptidyl peptidase IV inhibitors and their uses for lowering blood pressure levels DPP4, DPP3, DPP9 SLC7A5 354/4885DPP4 1/4885DPP7 5/4885
US-20060293248-A1 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents DPP4, DPP3, DNPEP SLC7A5 852/4885DPP4 1/4885DPP7 4/4885
US-20070207946-A1 Dipeptidyl peptidase IV inhibitors and their uses for lowering blood pressure levels DPP4, DPP3, DPP9 SLC7A5 354/4885DPP4 1/4885DPP7 5/4885
US-20050171025-A1 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents DPP4, DPP3, DNPEP SLC7A5 852/4885DPP4 1/4885DPP7 4/4885

“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.