SCHEMBL14320397

SCHEMBL14320397

N[C@H](CCCNC(=O)O)C(=O)NC[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 2/20 0.53
ANPEP P15144 1/20 0.50
MMP2 P08253 1/20 0.49
CTSL P07711 4/20 0.47
DPP8 Q6V1X1 2/20 0.47
DPP7 Q9UHL4 2/20 0.47
DPP4 P27487 1/20 0.46
DPP9 Q86TI2 1/20 0.46
CTSK P43235 3/20 0.46
SYK P43405 1/20 0.46
SLC1A3 P43003 1/20 0.45
SLC1A1 P43005 1/20 0.45
CTSB P07858 1/20 0.45
CTSS P25774 1/20 0.45
HTT P42858 1/20 0.44
TACR1 P25103 1/20 0.43

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
SCHEMBL14320399 1.00 CTRB1 (0.53) CTRB1ANPEPMMP2CTSLDPP8
SCHEMBL12295600 0.95 ANPEP (0.56) CTRB1ANPEPMMP2CTSLDPP8
SCHEMBL2266912 0.84 CTRB1 (0.49) CTRB1ANPEPMMP2CTSLDPP8
SCHEMBL2266918 0.84 CTRB1 (0.49) CTRB1ANPEPMMP2CTSLDPP8
SCHEMBL14320293 0.82 SYK (0.57) CTSLCTSKSYKCTSBCTSS
SCHEMBL14320294 0.82 SYK (0.57) CTSLCTSKSYKCTSBCTSS
Hydrochloric Acid SCHEMBL4889200 0.81 ANPEP (0.51) ANPEPDPP8DPP7DPP4DPP9
SCHEMBL12294699 0.81 CTRB1 (0.61) CTRB1CTSLCTSKSYKCTSB
SCHEMBL14643375 0.81 CTRB1 (0.61) CTRB1CTSLCTSKSYKCTSB
SCHEMBL22574555 0.79 CTRB1 (0.53) CTRB1CTSLSYKCTSSHTT

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
US-8598123-B2 Peptide analogues PFIZER INC. (US) 2013-12-03 US disclosed
US-20120329724-A1 PEPTIDE ANALOGUES PFIZER LIMITED 2012-12-27 US 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 (1 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-20120329724-A1 PEPTIDE ANALOGUES OPRL1, OGFR, OPRM1 CTRB1 1862/4885ANPEP 91/4885MMP2 3220/4885

“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.