SCHEMBL7934986

SCHEMBL7934986

CC(=O)C1CCCN1C(=O)C(N)C(C)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 11/20 0.61
DPP7 Q9UHL4 10/20 0.61
PREP P48147 4/20 0.61
FAP Q12884 7/20 0.48
DPP8 Q6V1X1 6/20 0.48
DPP9 Q86TI2 5/20 0.48
PITRM1 Q5JRX3 1/20 0.48
ACE P12821 6/20 0.44
REN P00797 3/20 0.44
KDM4E B2RXH2 1/20 0.44
F2 P00734 1/20 0.44
LMNA P02545 1/20 0.44
LTA4H P09960 1/20 0.44
MAPT P10636 1/20 0.44
PEPD P12955 1/20 0.44
ALOX15 P16050 1/20 0.44
PTGS1 P23219 1/20 0.44
HTR2A P28223 1/20 0.44
PTGS2 P35354 1/20 0.44
HRH1 P35367 1/20 0.44

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
SCHEMBL19165611 1.00 DPP4 (0.61) DPP4DPP7PREPFAPDPP8
SCHEMBL23794392 0.89 DPP4 (0.60) DPP4DPP7PREPFAPDPP8
SCHEMBL10056862 0.89 DPP4 (0.60) DPP4DPP7PREPFAPDPP8
SCHEMBL14865113 0.89 DPP4 (0.60) DPP4DPP7PREPFAPDPP8
SCHEMBL8892746 0.87 DPP4 (0.61) DPP4DPP7PREPFAPDPP8
SCHEMBL22542490 0.87 DPP4 (0.61) DPP4DPP7PREPFAPACE
SCHEMBL8892750 0.87 DPP4 (0.61) DPP4DPP7PREPFAPDPP8
SCHEMBL24419900 0.87 DPP4 (0.61) DPP4DPP7PREPFAPACE
SCHEMBL19167069 0.87 DPP4 (0.61) DPP4DPP7PREPFAPDPP8
SCHEMBL12285674 0.85 DPP4 (0.58) DPP4DPP7PREPFAPDPP8

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-9802946-B2 NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2017-10-31 US disclosed
US-9593145-B2 Secondary structure stabilized NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2017-03-14 US disclosed
US-9512133-B2 NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2016-12-06 US disclosed
US-20160115197-A1 SECONDARY STRUCTURE STABILIZED NMDA RECEPTOR MODULATORS AND USES THEREOF INNOVIVA TRC HOLDINGS LLC 2016-04-28 US disclosed
US-20150336969-A1 NMDA Receptor Modulators and Uses Thereof NAUREX, INC. 2015-11-26 US disclosed
US-9101612-B2 Secondary structure stabilized NMDA receptor modulators and uses thereof NORTHWESTERN UNIVERSITY (US) 2015-08-11 US disclosed
US-20150105364-A1 NMDA Receptor Modulators and Uses Thereof NORTHWESTERN UNIVERSITY (US) 2015-04-16 US disclosed
WO-2011100585-A1 SECONDARY STRUCTURE STABILIZED NMDA RECEPTOR MODULATORS AND USES THEREOF MOSKAL JOSEPH (US) 2011-08-18 WO disclosed
WO-2010033757-A1 NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2010-03-25 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 (3 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-20150336969-A1 NMDA Receptor Modulators and Uses Thereof GRIN1, GRIN2A, GRIN3A DPP4 1413/4885DPP7 1615/4885PREP 3459/4885
US-20150105364-A1 NMDA Receptor Modulators and Uses Thereof GRIN1, GRIN2A, GRIN3A DPP4 1413/4885DPP7 1615/4885PREP 3459/4885
US-20160115197-A1 SECONDARY STRUCTURE STABILIZED NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN2A, GRIN1, GRIN3A DPP4 2491/4885DPP7 2430/4885PREP 3855/4885

“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.