SCHEMBL4140917

SCHEMBL4140917

COc1ccc(C2=NOC3(CCN(C(=O)Nc4ccccc4)C3)C2)cc1OC1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 16/20 0.56
PDE4A P27815 14/20 0.56
PDE4D Q08499 13/20 0.56
PDE4C Q08493 12/20 0.56

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
SCHEMBL3669822 0.92 PDE4B (0.54) PDE4BPDE4APDE4DPDE4C
SCHEMBL3675896 0.88 PDE4B (0.57) PDE4BPDE4APDE4DPDE4C
SCHEMBL3672014 0.86 PDE4B (0.60) PDE4BPDE4APDE4DPDE4C
SCHEMBL5049520 0.85 PDE4B (0.58) PDE4BPDE4APDE4DPDE4C
SCHEMBL3677039 0.85 PDE4B (0.58) PDE4BPDE4APDE4DPDE4C
SCHEMBL3547203 0.84 PDE4B (0.62) PDE4BPDE4APDE4DPDE4C
SCHEMBL3673495 0.84 PDE4B (0.57) PDE4BPDE4APDE4DPDE4C
SCHEMBL3549331 0.83 PDE4D (0.55) PDE4BPDE4APDE4DPDE4C
SCHEMBL3673682 0.83 PDE4B (0.59) PDE4BPDE4APDE4DPDE4C
SCHEMBL3669273 0.83 PDE4B (0.58) PDE4BPDE4APDE4DPDE4C

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-20090048247-A1 CONDENSED ISOXALINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASE TYPE - IV RANBAXY LABORATORIES LIMITED (IN) 2009-02-19 US disclosed
EP-1869054-A2 CONDENSED ISOXALINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASE TYPE-IV Ranbaxy Laboratories Limited (IN) 2007-12-26 EP disclosed
WO-2006085212-A2 CONDENSED ISOXALINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASE TYPE-IV RANBAXY LABORATORIES LIMITED (IN) 2006-08-17 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-20090048247-A1 CONDENSED ISOXALINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASE TYPE - IV PDE3B, PDE4A, PDE3A PDE4B 4/4885PDE4A 2/4885PDE4D 11/4885

“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.