SCHEMBL147265

SCHEMBL147265

CC(C)(C)OC(=O)N[C@H]1CN(c2ncc(Br)cn2)C[C@@H]1N1CCCCC1=O

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.35
▸ DPP8 Q6V1X1 2/20 0.35
▸ VNN1 O95497 2/20 0.35
▸ JAK3 P52333 1/20 0.34
▸ BTK Q06187 1/20 0.34
▸ ACACB O00763 5/20 0.34
▸ EIF2AK4 Q9P2K8 1/20 0.33
▸ CKS1B P61024 1/20 0.33
▸ SKP1 P63208 1/20 0.33
▸ SKP2 Q13309 1/20 0.33
▸ GPR119 Q8TDV5 1/20 0.32
▸ MAP4K4 O95819 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32
▸ RELA Q04206 1/20 0.32
▸ FPR2 P25090 1/20 0.32

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
SCHEMBL1721356 1.00 DPP4 (0.35) DPP4DPP8VNN1JAK3BTK
SCHEMBL147266 1.00 DPP4 (0.35) DPP4DPP8VNN1JAK3BTK
SCHEMBL179044 0.89 RET (0.38) DPP4DPP8VNN1JAK3BTK
SCHEMBL8217907 0.79 DPP4 (0.43) DPP4DPP8VNN1JAK3BTK
SCHEMBL31638498 0.78 RET (0.43) ACACBEIF2AK4
SCHEMBL149123 0.78 EIF2AK4 (0.35) VNN1JAK3BTKACACBEIF2AK4
SCHEMBL149122 0.78 EIF2AK4 (0.35) VNN1JAK3BTKACACBEIF2AK4
SCHEMBL149124 0.78 EIF2AK4 (0.35) VNN1JAK3BTKACACBEIF2AK4
SCHEMBL148610 0.78 GPR119 (0.39) GPR119
SCHEMBL8221580 0.77 DPP4 (0.43) DPP4DPP8VNN1JAK3BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120059014-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-03-08 — — US disclosed
US-20120040953-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-02-16 — — US disclosed
US-20120040953-A1 Compounds for the Treatment of Metabolic Disorders PROSIDION LIMITED (GB) 2012-02-16 — — 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 (2 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-20120059014-A1 Compounds for the Treatment of Metabolic Disorders GPR119, FFAR2, GPBAR1 DPP4 407/4885DPP8 1048/4885VNN1 3619/4885
US-20120040953-A1 Compounds for the Treatment of Metabolic Disorders GPR119, GPR132, FFAR2 DPP4 217/4885DPP8 615/4885VNN1 2635/4885

“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.

Send feedback