SCHEMBL4126657

SCHEMBL4126657

CCCc1nc(C)c2c(C)nc3ccc(=O)[nH]c3n12

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 15/20 0.56
HCAR1 Q9BXC0 5/20 0.54
PDE3A Q14432 4/20 0.51
PDE4D Q08499 3/20 0.51
PDE2A O00408 3/20 0.51
PDE5A O76074 2/20 0.51
PDE11A Q9HCR9 2/20 0.51
PDE4A P27815 1/20 0.51
PDE7A Q13946 1/20 0.51
PDE7B Q9NP56 1/20 0.51

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
SCHEMBL4119915 0.77 HCAR1 (0.50) HCAR1
SCHEMBL4118542 0.72 PDE10A (0.53) PDE10AHCAR1PDE2APDE5APDE11A
SCHEMBL971822 0.70 PDE10A (0.63) PDE10APDE3APDE4DPDE2APDE5A
SCHEMBL4123016 0.69 PDE10A (0.57) PDE10APDE3APDE2APDE5APDE11A
SCHEMBL970643 0.69 PDE10A (0.57) PDE10APDE3APDE4DPDE2APDE5A
SCHEMBL11049421 0.68 PDE10A (0.47) PDE10APDE3APDE4DPDE2APDE5A
SCHEMBL3997814 0.68 PDE10A (1.00) PDE10APDE3APDE4DPDE2APDE5A
SCHEMBL18691778 0.67 HCAR1 (0.49) HCAR1
SCHEMBL969451 0.67 PDE10A (0.60) PDE10APDE3APDE4DPDE2APDE5A
SCHEMBL4112304 0.67 PDE10A (0.79) PDE10APDE3APDE4DPDE2APDE5A

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 5 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 disclosed
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 disclosed
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
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
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 10/4885HCAR1 3333/4885PDE3A 3/4885

“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.