SCHEMBL17178

SCHEMBL17178

CCOC(=O)[C@H](Cc1cccc(OC)c1)NC(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.49
POLB P06746 1/20 0.48
KLK5 Q9Y337 1/20 0.46
CTSK P43235 4/20 0.44
CTSS P25774 3/20 0.44
CTSB P07858 2/20 0.44
CTSL P07711 2/20 0.44
SCN9A Q15858 1/20 0.43
ACE P12821 1/20 0.42
GFER P55789 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TP53 P04637 1/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42

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
SCHEMBL17177 1.00 CACNA1B (0.49) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL2657639 0.93 POLB (0.56) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL2657638 0.93 POLB (0.56) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL1673614 0.87 KLK5 (0.56) POLBKLK5CTSKCTSSCTSB
SCHEMBL1673615 0.87 KLK5 (0.56) POLBKLK5CTSKCTSSCTSB
SCHEMBL30547272 0.82 KLK5 (0.58) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL31539528 0.82 KLK5 (0.58) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL19696789 0.82 CACNA1B (0.57) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL4729306 0.82 KLK5 (0.58) CACNA1BPOLBKLK5CTSKCTSS
SCHEMBL17582 0.82 KLK5 (0.41) POLBKLK5CTSKCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609081-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES Amgen Inc. (US) 2013-07-03 EP disclosed
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 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 (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-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES GCKR, GCK, SLC5A2 CACNA1B 4424/4885POLB 4613/4885KLK5 376/4885

“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.