SCHEMBL2877462

SCHEMBL2877462

NC12CC3CC(C1)CC(CC(=O)N1CCSC1)(C3)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
BPTF Q12830 1/20 0.46
DPP4 P27487 5/20 0.45
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
HSD11B1 P28845 1/20 0.41
TSHR P16473 1/20 0.39
GAA P10253 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.37
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 1/20 0.36
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL5789566 0.79 DPP9 (0.60) DPP4DPP8DPP9
SCHEMBL2869935 0.75 POLB (0.54) POLBBPTFDPP4GRIN2DGRIN3B
SCHEMBL5809837 0.72 POLB (1.00) POLBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5804593 0.70 DPP9 (0.55) DPP4DPP8DPP9
SCHEMBL2877465 0.68 DPP4 (0.40) BPTFDPP4DPP8DPP9DPP7
SCHEMBL19909607 0.66 BPTF (0.71) BPTFDPP4HSD11B1TSHRGAA
SCHEMBL6058620 0.64 GRIN2D (0.64) POLBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6052795 0.64
SCHEMBL10611575 0.64 DPP4 (0.47) DPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL8552428 0.63 DPP7 (0.51) DPP4DPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1794120-B1 PEPTIDASE INHIBITORS NUADA LLC (US) 2012-04-11 EP disclosed
US-7842707-B2 Peptidase inhibitors NUADA, LLC (US) 2010-11-30 US disclosed
US-20080234292-A1 Such as S)-(1-(1-Aminobicyclo[2.2.2]oct-4-yl)aminoacetyl)-2-cyanopyrrolidine; inhibitors of the enzyme dipeptidyl peptidase; antidiabetic agents NUADA, LLC 2008-09-25 US disclosed
EP-1794120-A2 PEPTIDASE INHIBITORS Royalty, Susan Marie (US) 2007-06-13 EP disclosed
WO-2006012395-A2 PEPTIDASE INHIBITORS ROYALTY SUSAN MARIE (US) 2006-02-02 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-20080234292-A1 Such as S)-(1-(1-Aminobicyclo[2.2.2]oct-4-yl)aminoacetyl)-2-cyanopyrrolidine; inhibitors of the enzyme dipeptidyl peptidase; antidiabetic agents DPP3, DPP4, DPP7 POLB 2452/4885BPTF 3001/4885DPP4 2/4885

“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.