SCHEMBL787736

SCHEMBL787736

NCCC[C@@H](N)C(=O)OC(=O)[C@@H]1CCCN1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 10/20 0.35
DPP4 P27487 5/20 0.35
DPP8 Q6V1X1 3/20 0.35
DPP9 Q86TI2 2/20 0.35
NOS2 P35228 2/20 0.33
FAP Q12884 1/20 0.33
GSR P00390 1/20 0.33
PRCP P42785 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
TLR2 O60603 2/20 0.32
ARG1 P05089 1/20 0.31
ARG2 P78540 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
SCHEMBL1537264 0.96 DPP7 (0.40) DPP7DPP4DPP8DPP9NOS2
SCHEMBL4241080 0.96 DPP7 (0.40) DPP7DPP4DPP8DPP9NOS2
SCHEMBL11660663 0.96 DPP7 (0.40) DPP7DPP4DPP8DPP9NOS2
SCHEMBL8697410 0.84 NOS2 (0.32) DPP7NOS2NOS3NOS1
SCHEMBL30716624 0.83 QARS1 (0.40) DPP7DPP4DPP8DPP9NOS2
SCHEMBL2201568 0.83 NOS2 (0.33) DPP7DPP4NOS2PRCPNOS3
SCHEMBL1275426 0.83 ALOX15 (0.38) DPP7DPP4DPP8DPP9NOS2
SCHEMBL20819053 0.83 PRCP (0.40) DPP7NOS2PRCPNOS3NOS1
SCHEMBL11324776 0.83 CPB2 (0.42) DPP7DPP4DPP8DPP9NOS2
SCHEMBL285831 0.82 NOS2 (0.37) DPP7DPP4DPP8DPP9NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106692120-A Medicine composition of lidocaine and application of medicine composition 刘力 2017-05-24 CN claimed
US-20160341667-A1 RAMAN SPECTROSCOPY FOR BIOPROCESS OPERATIONS ABBOTT LABORATORIES 2016-11-24 US disclosed
EP-2729570-A2 REAGENT USABLE FOR THE ISOLATION AND/OR PURIFICATION OF NUCLEIC ACIDS Qiagen GmbH (DE) 2014-05-14 EP disclosed
EP-2616814-A1 RAMAN SPECTROSCOPY FOR BIOPROCESS OPERATIONS AbbVie Inc. (US) 2013-07-24 EP disclosed
WO-2013004710-A2 REAGENT USABLE FOR THE ISOLATION AND/OR PURIFICATION OF NUCLEIC ACIDS QIAGEN GMBH (DE) 2013-01-10 WO disclosed
US-20120123688-A1 RAMAN SPECTROSCOPY FOR BIOPROCESS OPERATIONS ABBOTT LABORATORIES (US) 2012-05-17 US disclosed
WO-2012037430-A1 RAMAN SPECTROSCOPY FOR BIOPROCESS OPERATIONS ABBOTT LABORATORIES (US) 2012-03-22 WO disclosed
EP-0047516-A1 Propylamine derivative and process of manufacturing the same TORAY INDUSTRIES, INC. (JP) 1982-03-17 EP disclosed