SCHEMBL4127588

SCHEMBL4127588

Cc1nc(-c2cccc(C(N)=O)c2)n2c1c(C)nc1ccc(OCC3CC3)nc12

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 15/20 0.73
PDE2A O00408 10/20 0.73
PDE5A O76074 2/20 0.73
PDE7A Q13946 2/20 0.73
PDE11A Q9HCR9 2/20 0.73
PDE4D Q08499 1/20 0.54
PDE3A Q14432 1/20 0.54
CHEK2 O96017 3/20 0.40
PADI4 Q9UM07 1/20 0.39
LRRK2 Q5S007 1/20 0.38

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
SCHEMBL4110560 0.89 PDE10A (0.56) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4126250 0.88 PDE10A (0.55) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4126472 0.85 PDE10A (0.52) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4124604 0.85 PDE10A (0.52) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4116899 0.85 PDE10A (1.00) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4122606 0.84 PDE10A (0.51) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4135798 0.84 PDE10A (0.51) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4113032 0.84 PDE10A (0.50) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL3999636 0.77 PDE10A (0.80) PDE10APDE2APDE5APDE7APDE11A
SCHEMBL4128268 0.77 PDE10A (0.46) PDE10APDE2APDE5APDE7APDE11A

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
WO-2009070583-A1 PYRIDO[3,2-E]PYRAZINES, PROCESS FOR PREPARING THE SAME, AND THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10 WYETH (US) 2009-06-04 WO claimed
US-20090143361-A1 Pyrido[3,2-E]Pyrazines, Process For Preparing The Same, And Their Use As Inhibitors Of Phosphodiesterase 10 ELBION GMBH (DE) 2009-06-04 US claimed
US-20090143361-A1 Pyrido[3,2-E]Pyrazines, Process For Preparing The Same, And Their Use As Inhibitors Of Phosphodiesterase 10 ELBION GMBH (DE) 2009-06-04 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-20090143361-A1 Pyrido[3,2-E]Pyrazines, Process For Preparing The Same, And Their Use As Inhibitors Of Phosphodiesterase 10 PDE12, PDE5A, PDE3A PDE10A 10/4885PDE2A 4/4885PDE5A 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.