SCHEMBL4871814

SCHEMBL4871814

Oc1ccc(C2=NOC3(CCC3)C2)cc1OC1Cc2ccccc2C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 8/20 0.38
PDE4B Q07343 8/20 0.38
PDE4C Q08493 8/20 0.38
PDE4D Q08499 8/20 0.38
MAOA P21397 4/20 0.36
MAOB P27338 4/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CYP2C9 P11712 5/20 0.35
MIF P14174 1/20 0.33
KCNH2 Q12809 1/20 0.32
TRPM8 Q7Z2W7 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
SCHEMBL4876106 0.98 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DMAOA
SCHEMBL4880280 0.97 CYP2C9 (0.38) PDE4APDE4BPDE4CPDE4DMAOA
SCHEMBL3670635 0.88 PDE4A (0.34) PDE4APDE4BPDE4CPDE4DMAOA
SCHEMBL4872615 0.86 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL4876490 0.84 PDE4D (0.38) PDE4APDE4BPDE4CPDE4DCHRNB4
SCHEMBL4879467 0.84 PDE4A (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL4872718 0.83 PDE4B (0.39) PDE4APDE4BPDE4CPDE4DCHRNB4
SCHEMBL4871798 0.83 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DCHRNB4
SCHEMBL4878866 0.83 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL4872574 0.82 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DCHRNB4

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-20080009535-A1 Inhibitors of phosphodiesterase type-IV RANBAXY LABORATORIES LIMITED (IN) 2008-01-10 US claimed
EP-1840123-A1 Isoxazolines and their use as inhibitors of phosphodiesterase type-IV Ranbaxy Laboratories Limited (IN) 2007-10-03 EP claimed
US-20080009535-A1 Inhibitors of phosphodiesterase type-IV RANBAXY LABORATORIES LIMITED (IN) 2008-01-10 US disclosed
EP-1840123-A1 Isoxazolines and their use as inhibitors of phosphodiesterase type-IV Ranbaxy Laboratories Limited (IN) 2007-10-03 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-20080009535-A1 Inhibitors of phosphodiesterase type-IV PDE4A, PDE3B, PDE4B PDE4A 1/4885PDE4B 3/4885PDE4C 4/4885

“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.