SCHEMBL1031648

SCHEMBL1031648

COc1cc(C(=O)Cc2c(Cl)cncc2Cl)ccc1OC(F)F

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 13/20 0.80
PDE4A P27815 11/20 0.54
PDE4B Q07343 7/20 0.54
PDE4C Q08493 6/20 0.54
ABCB11 O95342 1/20 0.48

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
SCHEMBL1030283 0.93 PDE4D (0.67) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL6858835 0.90 PDE4D (0.63) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL1026961 0.89 PDE4D (1.00) PDE4DPDE4APDE4BPDE4C
SCHEMBL7356320 0.88 PDE4D (0.61) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL7356316 0.87 PDE4D (0.60) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL6858838 0.85 PDE4D (0.81) PDE4DPDE4APDE4BPDE4C
SCHEMBL6863990 0.84 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL1028814 0.83 PDE4B (0.71) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL7340773 0.82 PDE4D (0.76) PDE4DPDE4APDE4BPDE4C
SCHEMBL1434462 0.82 PDE4D (0.81) PDE4DPDE4APDE4BPDE4C

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
EP-2044023-B1 DERIVATIVES OF 1-PHENYL-2-PYRIDYNYL ALKYLENE ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMA SPA (IT) 2011-01-19 EP disclosed
US-7671066-B2 Derivatives of 1-phenyl-2-pyridynyl alkylene alcohols as phosphodiesterase inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2010-03-02 US disclosed
US-20080015226-A1 Derivatives of 1-phenyl-2-pyridynyl alkylene alcohols as phosphodiesterase inhibitors CHIESI FARMACEUTICI S.P.A.. 2008-01-17 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 (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-20080015226-A1 Derivatives of 1-phenyl-2-pyridynyl alkylene alcohols as phosphodiesterase inhibitors PDE4A, PDE4B, PDE12 PDE4D 9/4885PDE4A 1/4885PDE4B 2/4885

“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.