SCHEMBL2385264

SCHEMBL2385264

CC(C)(C)OC(=O)N1CCCN(c2nsnc2OCc2ccncc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.59
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
LIPA P38571 3/20 0.45
PDE10A Q9Y233 1/20 0.45
ALDH1A1 P00352 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TLR9 Q9NR96 2/20 0.43
TLR7 Q9NYK1 2/20 0.43
ACHE P22303 1/20 0.43

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
SCHEMBL2384061 0.96 GPR119 (0.63) GPR119ALDH1A1ALOX15TSHRMAPK1
SCHEMBL2386443 0.84 GPR119 (0.68) GPR119TLR9TLR7ACHE
SCHEMBL5572377 0.81 ALDH1A1 (0.56) GPR119LIPAALDH1A1ALOX15TSHR
SCHEMBL2385047 0.79 GPR119 (0.64) GPR119CKS1BSKP1SKP2TLR9
SCHEMBL20423837 0.78 ACHE (0.47) GPR119CKS1BSKP1SKP2ALDH1A1
SCHEMBL2385596 0.78 GPR119 (0.53) GPR119TLR9ACHE
SCHEMBL2386175 0.77 TRPV1 (0.47) ALDH1A1
SCHEMBL2383134 0.77 GPR119 (0.59) GPR119TLR9TLR7ACHE
SCHEMBL2385473 0.77 CKS1B (0.49) GPR119CKS1BSKP1SKP2ALDH1A1
SCHEMBL2385780 0.77 GPR119 (0.67) GPR119CKS1BSKP1SKP2TLR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
EP-1608373-A2 TIE-2 MODULATORS AND METHODS OF USE Exelixis Inc. (US) 2005-12-28 EP disclosed
WO-2004083235-A2 TIE-2 MODULATORS AND METHODS OF USE EXELIXIS INC. (US) 2004-09-30 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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR GPR119 686/4885CKS1B 192/4885SKP1 918/4885

“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.