SCHEMBL2855967

SCHEMBL2855967

N#Cc1cnc(N2CCN(CCCCC(N)C(=O)N3CCSC3)CC2)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 15/20 0.53
DPP7 Q9UHL4 5/20 0.44
DPP8 Q6V1X1 2/20 0.44
DPP9 Q86TI2 2/20 0.44
AKT1 P31749 2/20 0.40
AKT2 P31751 2/20 0.40
AKT3 Q9Y243 2/20 0.40
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL2855963 1.00 DPP4 (0.53) DPP4DPP7DPP8DPP9AKT1
SCHEMBL2855713 0.83 AKT1 (0.55) DPP4DPP7DPP8DPP9AKT1
SCHEMBL2859526 0.83 DPP4 (0.50) DPP4DPP7DPP8DPP9DRD2
SCHEMBL2855721 0.83 AKT1 (0.55) DPP4DPP7DPP8DPP9AKT1
SCHEMBL2859518 0.83 DPP4 (0.50) DPP4DPP7DPP8DPP9DRD2
SCHEMBL2860495 0.80 HTR1A (0.53) DRD2HTR2A
SCHEMBL2860498 0.80 HTR1A (0.53) DRD2HTR2A
SCHEMBL2878889 0.80 DPP4 (0.52) DPP4DPP7DPP8DPP9DRD2
SCHEMBL2878882 0.80 DPP4 (0.52) DPP4DPP7DPP8DPP9DRD2
SCHEMBL2857554 0.79 DRD2 (0.53) DPP4DPP7DPP8DPP9DRD2

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 3 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
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 (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-20070259880-A1 THIAZOLIDINE DERIVATIVES AND MEDICINAL USE THEREOF DPP4, DPP7, DPP3 DPP4 1/4885DPP7 2/4885DPP8 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.