SCHEMBL2859552

SCHEMBL2859552

CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCSC1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.66
DPP8 Q6V1X1 1/20 0.66
DPP9 Q86TI2 1/20 0.66
DPP7 Q9UHL4 1/20 0.66
ITGB3 P05106 1/20 0.60
ITGA2B P08514 1/20 0.60
TGM2 P21980 15/20 0.54
F13A1 P00488 2/20 0.53
TGM1 P22735 2/20 0.53
TGM6 O95932 1/20 0.53
KLK7 P49862 2/20 0.53
KLK5 Q9Y337 2/20 0.53
MAPT P10636 1/20 0.51

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
SCHEMBL2859559 1.00 DPP4 (0.66) DPP4DPP8DPP9DPP7ITGB3
SCHEMBL21009799 0.86 ITGB3 (0.62) ITGB3ITGA2BTGM2F13A1TGM1
SCHEMBL19707914 0.86 ITGB3 (0.62) ITGB3ITGA2BTGM2F13A1TGM1
SCHEMBL10074998 0.86 DPP4 (0.53) DPP4DPP8DPP9DPP7ITGB3
SCHEMBL10078264 0.86 DPP4 (0.53) DPP4DPP8DPP9DPP7ITGB3
SCHEMBL6766563 0.86 ITGB3 (0.65) ITGB3ITGA2BTGM2F13A1TGM1
SCHEMBL13598866 0.86 ITGB3 (0.65) ITGB3ITGA2BTGM2F13A1TGM1
SCHEMBL10074729 0.85 DPP8 (0.55) DPP4DPP8DPP9DPP7ITGB3
SCHEMBL28290510 0.85 ITGB3 (0.61) ITGB3ITGA2BTGM2F13A1TGM1
SCHEMBL28290512 0.85 ITGB3 (0.61) ITGB3ITGA2BTGM2F13A1TGM1

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
US-7790725-B2 Thiazolidine derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-07 US disclosed
US-20070259880-A1 THIAZOLIDINE DERIVATIVES AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORPORATION (JP) 2007-11-08 US disclosed
US-20040259883-A1 Thiazolidine derivative and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-12-23 US disclosed
EP-1426366-A1 THIAZOLIDINE DERIVATIVE AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2004-06-09 EP 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 (2 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-20070259880-A1 THIAZOLIDINE DERIVATIVES AND MEDICINAL USE THEREOF DPP4, DPP7, DPP3 DPP4 1/4885DPP8 5/4885DPP9 4/4885
US-20040259883-A1 Thiazolidine derivative and medicinal use thereof DPP4, DPP7, DPP3 DPP4 1/4885DPP8 5/4885DPP9 4/4885

“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.