SCHEMBL6402430

SCHEMBL6402430

Nc1cccc(C2=NNC(=O)C3CCCCC23)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 13/20 0.57
PDE4B Q07343 13/20 0.57
PDE4C Q08493 13/20 0.57
PDE4D Q08499 13/20 0.57
GPR119 Q8TDV5 5/20 0.48
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL6403046 1.00 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL6402428 1.00 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL11383040 0.86 GPR119 (0.53) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL1251645 0.79 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL1251878 0.76 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL11092220 0.76 GPR119 (0.60) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL6400925 0.75 PDE3B (0.56) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL11781780 0.74 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DGPR119
SCHEMBL4110471 0.73 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL4120473 0.73 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059658-A1 Pyridazinone BAYER AKTIENGESELLSCHAFT (DE) 2005-03-17 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-20050059658-A1 Pyridazinone TYMP, TPMT, PDXK PDE4A 784/4885PDE4B 934/4885PDE4C 1066/4885

“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.