SCHEMBL5987260

SCHEMBL5987260

COC1CCC(N(C)C(C)=O)C1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCL2A1 Q16548 1/20 0.38
ACHE P22303 1/20 0.32
DPP4 P27487 4/20 0.31
EPHX2 P34913 1/20 0.31
DPP8 Q6V1X1 2/20 0.31
DPP7 Q9UHL4 2/20 0.31
DPP9 Q86TI2 1/20 0.31

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
SCHEMBL12409407 0.88 DPP4 (0.35) BCL2A1DPP4EPHX2DPP8DPP7
SCHEMBL12409408 0.88 DPP4 (0.35) BCL2A1DPP4EPHX2DPP8DPP7
SCHEMBL21592439 0.86 DPP4 (0.31) BCL2A1DPP4DPP8DPP7DPP9
SCHEMBL5506106 0.76
SCHEMBL11982801 0.75 DPP4 (0.34) BCL2A1ACHEDPP4DPP8DPP7
SCHEMBL12571498 0.74
SCHEMBL29919339 0.74 CHRNB2 (0.38)
SCHEMBL7601801 0.74 DPP4 (0.33) BCL2A1ACHEDPP4DPP8DPP7
SCHEMBL26430504 0.72 DPP4 (0.33) BCL2A1ACHEDPP4DPP8DPP7
SCHEMBL15945069 0.72 DPP4 (0.41) BCL2A1ACHEDPP4DPP8DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US disclosed
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
EP-2447264-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-05-02 EP disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
WO-2010150840-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE 大日本住友製薬株式会社 (JP) 2010-12-29 WO disclosed
EP-2243779-A1 BICYCLIC HETEROCYCLIC DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2010-10-27 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-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE REN, AGTR1, AGTR2 BCL2A1 641/4885ACHE 1473/4885DPP4 1330/4885
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE REN, AGTR1, AGTR2 BCL2A1 589/4885ACHE 2217/4885DPP4 1070/4885

“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.