SCHEMBL8901251

SCHEMBL8901251

Cc1ccccc1-c1c(O)c(C(C)C)nn(CCc2ccc(Cl)cc2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASR P41180 3/20 0.37
MAPT P10636 4/20 0.36
TP53 P04637 4/20 0.36
TRPA1 O75762 4/20 0.36
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
ADRA1B P35368 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
LMNA P02545 1/20 0.35
MDM2 Q00987 1/20 0.35

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
SCHEMBL8901211 0.91 CASR (0.43) CASRMAPTTP53PDE4APDE4B
SCHEMBL8901922 0.90 LMNA (0.41) MAPTLMNA
SCHEMBL8901068 0.88 TP53 (0.40) CASRMAPTTP53TRPA1ADRA1A
SCHEMBL8901247 0.87 ADRA1A (0.38) CASRMAPTTP53TRPA1ADRA1A
SCHEMBL8902477 0.85 TACR1 (0.44) LMNA
SCHEMBL8901050 0.85 ADRA1A (0.40) CASRMAPTTP53TRPA1ADRA1A
SCHEMBL8901055 0.84 ADRA1A (0.39) CASRMAPTTP53TRPA1ADRA1A
SCHEMBL11965014 0.83 PTGS2 (0.38) LMNA
SCHEMBL8902971 0.82 PDE5A (0.44) PDE4APDE4BPDE4CPDE4D
SCHEMBL11965018 0.81 MAPT (0.36) MAPTPDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188008-B2 Herbicidally and insecticidally active 4-phenyl-substituted pyridazinones BAYER CROPSCIENCE AG (DE) 2012-05-29 US disclosed
US-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2010-07-08 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-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES CYP4X1, PRDX4, PRDX1 CASR 3764/4885MAPT 4430/4885TP53 4754/4885

“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.