SCHEMBL16587804

SCHEMBL16587804

C[C@@H]1CN(c2ccncc2N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C[C@H](C)[C@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.34
KDM4D Q6B0I6 1/20 0.33
CYP46A1 Q9Y6A2 1/20 0.31
NAMPT P43490 1/20 0.31
PIM2 Q9P1W9 3/20 0.30
PIM1 P11309 2/20 0.30
PIM3 Q86V86 2/20 0.30

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
SCHEMBL19099542 0.90 EIF2AK4 (0.33) GPR119KDM4DNAMPT
SCHEMBL15534924 0.90 EIF2AK4 (0.33) GPR119KDM4DNAMPT
SCHEMBL16587791 0.86 PIM2 (0.38) GPR119KDM4DPIM2PIM1PIM3
SCHEMBL16587806 0.84 GPR119 (0.34) GPR119NAMPT
SCHEMBL15873424 0.82 EIF2AK4 (0.33) GPR119KDM4DNAMPT
SCHEMBL16587837 0.82 GPR119 (0.34) GPR119KDM4DCYP46A1NAMPTPIM2
SCHEMBL16587834 0.79 PIM2 (0.41) GPR119KDM4DCYP46A1NAMPTPIM2
SCHEMBL15883556 0.79 PIM2 (0.35) KDM4DPIM2PIM1PIM3
SCHEMBL16508279 0.78 EIF2AK4 (0.32) GPR119KDM4DNAMPT
SCHEMBL18430031 0.77 EIF2AK4 (0.36) PIM2PIM1PIM3

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-20150336960-A1 ARYL-SUBSTITUTED FUSED BICYCLIC PYRIDAZINE COMPOUNDS NOVARTIS AG (CH) 2015-11-26 US disclosed
US-9173883-B2 Ring-substituted N-pyridinyl amides as kinase inhibitors NOVARTIS AG (CH) 2015-11-03 US disclosed
US-20150150873-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2015-06-04 US disclosed
US-20150133473-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2015-05-14 US disclosed
US-8987457-B2 Ring-substituted N-pyridinyl amides as kinase inhibitors NOVARTIS AG (CH) 2015-03-24 US 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 (3 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-20150133473-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS PIM1, PIM2, MAP3K1 GPR119 702/4885KDM4D 2498/4885CYP46A1 2233/4885
US-20150150873-A1 NOVEL RING-SUBSTITUTED N-PYRIDINYL AMIDES AS KINASE INHIBITORS PIM1, PIM2, MAP3K1 GPR119 702/4885KDM4D 2498/4885CYP46A1 2233/4885
US-20150336960-A1 ARYL-SUBSTITUTED FUSED BICYCLIC PYRIDAZINE COMPOUNDS PIM1, PIM2, PIM3 GPR119 995/4885KDM4D 3336/4885CYP46A1 1564/4885

“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.