SCHEMBL4029913

SCHEMBL4029913

CCN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.62
KCNH2 Q12809 1/20 0.62
CCR5 P51681 12/20 0.58

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
SCHEMBL13797803 0.86 GPR119 (0.57) GPR119CCR5
SCHEMBL14446775 0.85 CCR5 (0.60) GPR119CCR5
SCHEMBL6091638 0.82 CCR5 (0.65) CCR5
SCHEMBL6091632 0.82 CCR5 (0.65) CCR5
SCHEMBL4978196 0.79 GPR119 (0.52) GPR119
SCHEMBL6645701 0.77 CCR5 (0.62) GPR119KCNH2CCR5
SCHEMBL6673386 0.77 CCR5 (0.57) GPR119KCNH2CCR5
SCHEMBL1576264 0.77 GPR119 (0.71) GPR119
SCHEMBL2768189 0.77 KCNH2 (0.80) GPR119KCNH2CCR5
SCHEMBL2769377 0.77 KCNH2 (0.61) GPR119KCNH2CCR5

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-7547789-B2 Process for the preparation of N-(4-piperidinyl)-N-ethyl-phenylacetamides from N-Boc-4-oxopiperidine ASTRAZENECA AB (SE) 2009-06-16 US disclosed
US-20080214824-A1 Process for the Preparation of N-(4-Piperidinyl)-N-Ethyl-Phenylacetamides from N-Boc-4-Oxopiperidine ASTRAZENECA AB (SE) 2008-09-04 US disclosed
EP-1828128-A1 PROCESS FOR THE PREPARATION OF N-(4-PIPERIDINYL)-N-ETHYL-PHENYLACETAMIDES FROM N-BOC-4-OXOPIPERIDINE AstraZeneca AB (SE) 2007-09-05 EP disclosed
US-20070161646-A1 Piperidine Derivatives and Their Use as Modulators of Chemokine Receptor Activity (Especially CCR5) ASTRAZENECA AB (SE) 2007-07-12 US disclosed
WO-2006064221-A1 PROCESS FOR THE PREPARATION OF N- (4-PIPERIDINYL) -N-ETHYL-PHENYLACETAMIDES FROM N-BOC-4-OXOPIPERIDINE ASTRAZENECA AB (SE) 2006-06-22 WO disclosed
EP-1448548-A1 PIPERIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY (ESPECIALLY CCR5) AstraZeneca AB (SE) 2004-08-25 EP disclosed
WO-2003042205-A1 PIPERIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY (ESPECIALLY CCR5) ASTRAZENECA AB (SE) 2003-05-22 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 (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-20070161646-A1 Piperidine Derivatives and Their Use as Modulators of Chemokine Receptor Activity (Especially CCR5) CCR5, CCR2, CCL5 GPR119 165/4885KCNH2 2988/4885CCR5 1/4885
US-20080214824-A1 Process for the Preparation of N-(4-Piperidinyl)-N-Ethyl-Phenylacetamides from N-Boc-4-Oxopiperidine NISCH, NPPA, AZI2 GPR119 3530/4885KCNH2 139/4885CCR5 1084/4885

“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.