SCHEMBL1638992

SCHEMBL1638992

O=C1CCC(c2ccc3c(c2)CCN(C2=CC=C2)CC3)=NN1CC(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.46
PDE4B Q07343 7/20 0.35
PDE4D Q08499 3/20 0.35
PDE4A P27815 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
PGR P06401 1/20 0.32
ORAI1 Q96D31 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL1640001 0.86 PDE4B (0.39) HRH3PDE4BPDE4DPDE4APDE4C
SCHEMBL1640643 0.84 PDE4B (0.41) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL1640091 0.83 PDE4B (0.48) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL1640656 0.82 PDE3B (0.47) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL1638989 0.80 HRH3 (0.48) HRH3PDE4B
SCHEMBL1638994 0.77 HRH3 (0.40) HRH3PDE4BPDE4DPDE4APDE4C
SCHEMBL1640871 0.76 HRH3 (0.40) HRH3PDE4BPDE4DPDE4APDE4C
SCHEMBL1639549 0.75 PDE4B (0.33) HRH3PDE4BPDE4DPDE4APDE4C
SCHEMBL1639981 0.73 PDE3B (0.46) PDE4BPDE4DPDE4APDE4CPDE3B
SCHEMBL1640631 0.66 PDE3B (0.42) HRH3PDE4BPDE4DPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328586-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS Cephalon, Inc. (US) 2011-06-08 EP claimed
US-20110098269-A1 Substituted Pyridazinone Derivatives as Histamine-3 (H3) Receptor Ligands CEPHALON, INC. (US) 2011-04-28 US claimed
WO-2009142732-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2009-11-26 WO claimed
EP-2328586-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS Cephalon, Inc. (US) 2011-06-08 EP disclosed
US-20110098269-A1 Substituted Pyridazinone Derivatives as Histamine-3 (H3) Receptor Ligands CEPHALON, INC. (US) 2011-04-28 US disclosed
WO-2009142732-A2 SUBSTITUTED PYRIDAZINONE DERIVATIVES AS HISTAMINE-3 (H3) RECEPTOR LIGANDS CEPHALON, INC. (US) 2009-11-26 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-20110098269-A1 Substituted Pyridazinone Derivatives as Histamine-3 (H3) Receptor Ligands HRH3, HRH4, HRH2 HRH3 1/4885PDE4B 858/4885PDE4D 992/4885

“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.