SCHEMBL15029862

SCHEMBL15029862

C[C@H](N)C(=O)N(CCC#N)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.50
FNTA P49354 5/20 0.38
FNTB P49356 5/20 0.38
F10 P00742 4/20 0.38
NAMPT P43490 1/20 0.36

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
SCHEMBL11715332 0.78 FNTA (0.42) DPP4FNTAFNTBF10NAMPT
SCHEMBL8719745 0.75 FNTA (0.46) DPP4FNTAFNTBF10NAMPT
SCHEMBL10272672 0.75 FNTA (0.46) DPP4FNTAFNTBNAMPT
SCHEMBL9072487 0.74 DPP4 (0.40) DPP4FNTAFNTBF10NAMPT
SCHEMBL10223242 0.73 DPP4 (0.45) DPP4FNTAFNTBF10NAMPT
SCHEMBL15029863 0.72 DPP4 (0.40) DPP4
SCHEMBL11716231 0.71 DPP4 (0.42) DPP4FNTAFNTBF10NAMPT
SCHEMBL8295445 0.71 DPP4 (0.70) DPP4
SCHEMBL15029451 0.71 DPP4 (0.39) DPP4
SCHEMBL18711467 0.70 DPP4 (0.41) DPP4FNTAFNTBF10NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130150364-A1 HETEROCYCLIC COMPOUND ASTELLAS PHARMA INC. (JP) 2013-06-13 US 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-20130150364-A1 HETEROCYCLIC COMPOUND IL2, NFATC1, ICOS DPP4 4111/4885FNTA 1648/4885FNTB 1303/4885

“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.