SCHEMBL3217772

SCHEMBL3217772

COCCOc1ccc(/C=C/C(=O)O)c(OC2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.46
PDE4A P27815 2/20 0.46
PDE4C Q08493 2/20 0.46
PDE4D Q08499 2/20 0.46
ERBB2 P04626 2/20 0.44
GPR119 Q8TDV5 10/20 0.43
PDE3B Q13370 1/20 0.42
PDE3A Q14432 1/20 0.42
CHEK2 O96017 1/20 0.42

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
SCHEMBL3217780 1.00 PDE4B (0.46) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3219859 0.90 PDE4D (0.45) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3219848 0.90 PDE4D (0.45) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3903784 0.84 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DGPR119
SCHEMBL3206840 0.83 PPARG (0.58) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3206854 0.83 PPARG (0.58) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3202842 0.83 HDAC8 (0.43) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3202826 0.83 HDAC8 (0.43) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL3904350 0.81 PDE4B (0.48) PDE4BPDE4APDE4CPDE4DERBB2
SCHEMBL23465733 0.80 GPR119 (0.62) PDE4BPDE4APDE4CPDE4DGPR119

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-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 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 (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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PDE4B 444/4885PDE4A 251/4885PDE4C 562/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 PDE4B 738/4885PDE4A 345/4885PDE4C 941/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PDE4B 444/4885PDE4A 251/4885PDE4C 562/4885

“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.