SCHEMBL1640871

SCHEMBL1640871

O=c1ccc(-c2ccc3c(c2)CCN(C2=CC=C2)CC3)nn1CC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.40
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
HSD11B1 P28845 1/20 0.35
CYP2C19 P33261 1/20 0.35
MET P08581 2/20 0.33
PDE4A P27815 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
TP53 P04637 2/20 0.31
USP2 O75604 2/20 0.31
ALOX15 P16050 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SIK2 Q9H0K1 1/20 0.30

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
SCHEMBL1640497 0.84 HRH3 (0.40) HRH3CA1CA2CYP3A4CYP2C9
SCHEMBL1640533 0.83 CA1 (0.36) HRH3CA1CA2PDE4APDE4B
SCHEMBL1640859 0.82 PDE4A (0.40) CA1CA2PDE4APDE4BPDE4C
SCHEMBL1639547 0.80 HRH3 (0.44) HRH3CA1CA2
SCHEMBL1640869 0.79 HRH3 (0.46) HRH3CA1CA2
SCHEMBL1640484 0.78 BMPR1B (0.44) HRH3CA1CA2HSD11B1TP53
SCHEMBL1638992 0.76 HRH3 (0.46) HRH3PDE4APDE4BPDE4CPDE4D
SCHEMBL1640631 0.72 PDE3B (0.42) HRH3CYP2C9CYP2C19PDE4APDE4B
SCHEMBL1638976 0.72 CA1 (0.58) CA1CA2
SCHEMBL1639985 0.68 NPBWR1 (0.35) HRH3SMN1; SMN2SIK2

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 1/4885CA1 3303/4885CA2 2119/4885

“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.