SCHEMBL2849729

SCHEMBL2849729

Cc1cc(C)n(C2CCN([C@H]3C[C@@H](C(=O)N4CCSC4)N(C(=O)OC(C)(C)C)C3)CC2)n1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.41
DPP4 P27487 13/20 0.36
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 3/20 0.36
PTGS2 P35354 1/20 0.36
HRH1 P35367 1/20 0.36
KCNH2 Q12809 1/20 0.36
KDM5A P29375 1/20 0.34
HSD17B10 Q99714 1/20 0.33
TGM2 P21980 1/20 0.33
GPR119 Q8TDV5 1/20 0.33

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
SCHEMBL5456703 0.88 DRD2 (0.40) PREPDPP4DPP8DPP9PTGS2
SCHEMBL2854018 0.83 PREP (0.39) PREPDPP4DPP8DPP9PTGS2
SCHEMBL2855851 0.83 GPR119 (0.42) PREPDPP4KDM5AHSD17B10TGM2
SCHEMBL2852502 0.82 USP30 (0.39) PREPDPP4DPP8DPP9PTGS2
SCHEMBL2710385 0.82 DPP4 (0.45) PREPDPP4DPP8DPP9PTGS2
SCHEMBL2710642 0.82 PREP (0.50) PREPDPP4DPP8DPP9HSD17B10
SCHEMBL2725905 0.81 HSD17B10 (0.52) PREPDPP4HSD17B10
SCHEMBL2709609 0.81 PREP (0.50) PREPDPP4DPP8DPP9HSD17B10
SCHEMBL2711676 0.80 DPP4 (0.46) PREPDPP4GPR119
SCHEMBL2708268 0.80 PREP (0.43) PREPDPP4DPP8DPP9HSD17B10

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 PREP 391/4885DPP4 1/4885DPP8 5/4885
US-20040259883-A1 Thiazolidine derivative and medicinal use thereof DPP4, DPP7, DPP3 PREP 487/4885DPP4 1/4885DPP8 5/4885

“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.