SCHEMBL6833145

SCHEMBL6833145

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2c1OCCO2

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 17/20 0.65
PDE4B Q07343 16/20 0.57
PDE4A P27815 15/20 0.57
PDE4C Q08493 15/20 0.57
GFER P55789 1/20 0.57
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
HSD17B10 Q99714 1/20 0.54
PDE11A Q9HCR9 1/20 0.53

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
SCHEMBL6836687 0.95 PDE4D (0.62) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL6833314 0.95 PDE4D (0.62) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL6833375 0.88 KDM4E (0.57) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL5723285 0.87 PDE4D (0.61) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5798456 0.82 PDE4D (0.63) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL3307253 0.82 PDE4A (0.62) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5723181 0.81 PDE4A (0.64) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL5722882 0.81 PDE4D (0.58) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL8269091 0.80 PDE4D (0.60) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL6838082 0.79 PDE4D (0.65) PDE4DPDE4BPDE4APDE4CKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6716987-B1 PHOSPHODIESTERASE IV INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-04-06 US disclosed
US-6514996-B2 Derivatives of benzofuran or benzodioxole KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-02-04 US disclosed
US-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-09-12 US disclosed
EP-0943613-A1 OXYGENIC HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1999-09-22 EP 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-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE CBR1, CBR3, CYC1 PDE4D 4870/4885PDE4B 4877/4885PDE4A 4879/4885

“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.