SCHEMBL3934713

SCHEMBL3934713

CC(C)(C)OC(=O)N1CCC(Oc2cccc3[nH]ccc23)CC1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.55
KDM1A O60341 1/20 0.54
JAK2 O60674 3/20 0.51
JAK1 P23458 3/20 0.51
TYK2 P29597 3/20 0.51
JAK3 P52333 2/20 0.51
PDE4B Q07343 3/20 0.50
PDE4D Q08499 3/20 0.50
PDE4A P27815 2/20 0.50
PDE4C Q08493 2/20 0.50
BRD4 O60885 1/20 0.49

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
SCHEMBL6491533 0.93 GPR119 (0.48) GPR119KDM1AJAK2JAK1TYK2
SCHEMBL5241503 0.83 KDM1A (0.53) GPR119KDM1APDE4BPDE4DPDE4A
SCHEMBL14143336 0.83 JAK1 (0.57) GPR119JAK2JAK1TYK2JAK3
SCHEMBL5454387 0.82 GPR119 (0.57) GPR119KDM1APDE4BPDE4DPDE4A
SCHEMBL3928952 0.81 JAK2 (0.46) GPR119JAK2JAK1BRD4
SCHEMBL19297086 0.79 BRD4 (0.53) GPR119KDM1AJAK2JAK1TYK2
SCHEMBL30885791 0.79 GAA (0.60)
SCHEMBL1537795 0.79 GAA (0.60)
SCHEMBL19402410 0.79 KDM1A (0.58) GPR119KDM1APDE4BPDE4DPDE4A
SCHEMBL19839235 0.78 PDE4B (0.64) GPR119KDM1APDE4BPDE4DPDE4A

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-8222261-B2 Chemical compounds GlaxoSmithKline, LLC (US) 2012-07-17 US disclosed
US-20090318477-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2009-12-24 US disclosed
EP-2043744-A2 CHEMICAL COMPOUNDS SmithKline Beecham Corporation (US) 2009-04-08 EP disclosed
WO-2008008895-A1 GPR119 AGONISTS FOR THE TREATMENT OF DIABETES AND RELATED DISORDERS SMITHKLINE BEECHAM CORPORATION (US) 2008-01-17 WO disclosed
WO-2008008887-A2 GPR119 AGONISTS FOR TREATING METABOLIC DISORDERS SMITHKLINE BEECHAM CORPORATION (US) 2008-01-17 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-20090318477-A1 CHEMICAL COMPOUNDS GPR119, GOT2, SLC5A2 GPR119 1/4885KDM1A 4302/4885JAK2 1045/4885

“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.