SCHEMBL4698314

SCHEMBL4698314

CC(C)C(=O)OC(OC(=O)C(N)C1CCC(C(=O)O)CC1)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.37
DPP7 Q9UHL4 6/20 0.34
KCNH2 Q12809 1/20 0.34
ANPEP P15144 1/20 0.31
ENPEP Q07075 1/20 0.31
EPHX1 P07099 1/20 0.31
DPP8 Q6V1X1 2/20 0.31
DPP9 Q86TI2 2/20 0.31
FAP Q12884 1/20 0.31
GRM2 Q14416 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
SCHEMBL916672 1.00 DPP4 (0.37) DPP4DPP7KCNH2ANPEPENPEP
SCHEMBL916106 0.85 DPP4 (0.33) DPP4DPP7KCNH2ANPEPENPEP
SCHEMBL8216296 0.85 DPP4 (0.33) DPP4DPP7KCNH2ANPEPENPEP
SCHEMBL915152 0.84 ANPEP (0.35) ANPEPENPEP
SCHEMBL915150 0.84 ANPEP (0.35) ANPEPENPEP
SCHEMBL4699309 0.81 ANPEP (0.33) ANPEPENPEP
SCHEMBL914976 0.81 ANPEP (0.33) ANPEPENPEP
SCHEMBL916188 0.79 ANPEP (0.35) ANPEPENPEP
SCHEMBL3256826 0.79 ANPEP (0.35) ANPEPENPEP
Acetic Acid SCHEMBL614056 0.78 DPP4 (0.40) DPP4DPP7KCNH2EPHX1DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919859-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE Xenoport, Inc. (US) 2008-05-14 EP disclosed
WO-2007002013-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2007-01-04 WO disclosed