SCHEMBL952604

SCHEMBL952604

CC(C)(C)OC(=O)NC1CCN(c2ccc(F)nc2)C1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.51
SKP1 P63208 1/20 0.51
SKP2 Q13309 1/20 0.51
SUV39H2 Q9H5I1 7/20 0.49
CTSK P43235 2/20 0.47
PDE10A Q9Y233 2/20 0.47
BTK Q06187 2/20 0.47
JAK3 P52333 1/20 0.47
MAP4K4 O95819 2/20 0.46
PIM1 P11309 1/20 0.46
PIM3 Q86V86 1/20 0.46
PIM2 Q9P1W9 1/20 0.46
MET P08581 1/20 0.46
SYK P43405 1/20 0.46

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
SCHEMBL952899 1.00 CKS1B (0.51) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL4828925 0.87 JAK3 (0.52) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL29689849 0.87 CCNC (0.57) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL22499860 0.87 CCNC (0.57) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL1995443 0.86 MAP4K4 (0.51) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL30316309 0.86 MAP4K4 (0.51) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL16544562 0.86 KDM4D (0.52) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL1413310 0.86 KDM4D (0.52) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL16434657 0.86 KDM4D (0.52) CKS1BSKP1SKP2SUV39H2CTSK
SCHEMBL22499828 0.84 CKS1B (0.48) CKS1BSKP1SKP2SUV39H2CTSK

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
US-7868014-B2 1-(hetero)aryl-3-amino-pyrrolidine derivatives for use as mGluR3 antagonists ELI LILLY AND COMPANY (US) 2011-01-11 US disclosed
EP-1805165-B1 1-(HETERO)ARYL-3-AMINO-PYRROLIDINE DERIVATIVES FOR USE AS MGLUR3 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2009-12-16 EP disclosed
US-20080300266-A1 1-(Hetero)Aryl-3-Amino-Pyrrolidine Derivatives for Use as Mglur3 Antagonists ELI LILLY AND COMPANY (US) 2008-12-04 US disclosed
EP-1805165-A1 1-(HETERO)ARYL-3-AMINO-PYROLLIDINE DERIVATIVES FOR USE AS MGLUR3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-07-11 EP disclosed
WO-2006044454-A1 1-(HETERO)ARYL-3-AMINO-PYROLLIDINE DERIVATIVES FOR USE AS MGLUR3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-04-27 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-20080300266-A1 1-(Hetero)Aryl-3-Amino-Pyrrolidine Derivatives for Use as Mglur3 Antagonists GRM3, GRM1, GRIA3 CKS1B 3098/4885SKP1 2653/4885SKP2 3470/4885

“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.