SCHEMBL2385596

SCHEMBL2385596

CC(C)(C)OC(=O)N1CCN(c2nsnc2NCc2ccncc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.53
ACHE P22303 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
GBA1 P04062 2/20 0.42
TLR9 Q9NR96 1/20 0.42
KIT P10721 3/20 0.42
NAMPT P43490 1/20 0.42
TBK1 Q9UHD2 1/20 0.41

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 0.81 GPR119 (0.63) GPR119ACHEGBA1TLR9KIT
SCHEMBL18282621 0.78 JAK2 (0.49) GPR119ACHELMNAMAPTGBA1
SCHEMBL2385264 0.78 GPR119 (0.59) GPR119ACHETLR9
SCHEMBL18282571 0.76 NAMPT (0.43) GPR119SMN1; SMN2MEN1KMT2AHTT
SCHEMBL18282634 0.76 GPR119 (0.47) GPR119ACHESMN1; SMN2MEN1KMT2A
SCHEMBL18282631 0.75 JAK2 (0.49) GPR119ACHEGBA1KITNAMPT
SCHEMBL2386443 0.74 GPR119 (0.68) GPR119ACHETLR9KIT
SCHEMBL20423837 0.74 ACHE (0.47) GPR119ACHEMEN1KMT2AGBA1
SCHEMBL2384235 0.73 POLB (0.48) GPR119SMN1; SMN2MEN1KMT2AHTT
SCHEMBL13587106 0.73 MAPT (0.63) GPR119SMN1; SMN2MEN1KMT2ACYP2C19

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 686/4885ACHE 3013/4885SMN1; SMN2 3129/4885

“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.