SCHEMBL16853543

SCHEMBL16853543

CC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.49
PRCP P42785 2/20 0.44
CTSC P53634 3/20 0.42
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
TLR2 O60603 2/20 0.38
PSMB8 P28062 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36

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
Acetic Acid SCHEMBL30771391 0.89 DPP7 (0.46) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL10537153 0.89 DPP7 (0.48) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL6401404 0.89 DPP7 (0.48) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL30729221 0.89 DPP7 (0.48) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL30729269 0.89 DPP7 (0.48) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL25728331 0.87 DPP7 (0.47) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL30866235 0.87 DPP7 (0.47) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL21955441 0.87 DPP7 (0.47) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL31072135 0.87 DPP7 (0.47) DPP7PRCPCTSCCYP3A4CYP2D6
SCHEMBL24224255 0.86 TSHR (0.48) DPP7PRCPCTSCCYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015091304-A1 PATIENT INTERFACE KONINKLIJKE PHILIPS N.V. (NL) 2015-06-25 WO disclosed