SCHEMBL14361935

SCHEMBL14361935

COc1ccc2nc(C)c3nnc(-c4cnccc4C)n3c2c1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 19/20 0.72
PDE10A Q9Y233 16/20 0.72
PDE6D O43924 2/20 0.64
PDE6A P16499 2/20 0.64
PDE6G P18545 2/20 0.64
PDE6B P35913 2/20 0.64
PDE6C P51160 2/20 0.64
PDE6H Q13956 2/20 0.64

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
SCHEMBL14361857 0.84 PDE2A (0.73) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL971635 0.84 PDE10A (1.00) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14361972 0.82 PDE2A (0.70) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14473948 0.81 PDE2A (0.69) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14361873 0.78 PDE2A (0.83) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL3325445 0.78 PDE2A (1.00) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL3326092 0.77 PDE10A (0.79) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14362096 0.76 PDE2A (0.69) PDE2APDE10A
SCHEMBL14473919 0.76 PDE2A (0.61) PDE2APDE10APDE6DPDE6APDE6G
SCHEMBL14361750 0.75 PDE2A (1.00) PDE2APDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140147386-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2014-05-29 US claimed
EP-2723744-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES Janssen Pharmaceutica, N.V. (BE) 2014-04-30 EP claimed
WO-2013000924-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-01-03 WO claimed
US-10604523-B2 1-aryl-4-methyl-[1,2,4]triazolo[4,3-a]quinoxaline derivatives JANSSEN PHARMACEUTICA NV (BE) 2020-03-31 US disclosed
US-20140147386-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2014-05-29 US disclosed
EP-2723744-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES Janssen Pharmaceutica, N.V. (BE) 2014-04-30 EP disclosed
WO-2013000924-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-01-03 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 (2 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-20140147386-A1 1-ARYL-4-METHYL-[1,2,4]TRIAZOLO[4,3-a]QUINOXALINE DERIVATIVES PDE2A, PDE12, PDE5A PDE2A 1/4885PDE10A 10/4885PDE6D 24/4885
US-10604523-B2 1-aryl-4-methyl-[1,2,4]triazolo[4,3-a]quinoxaline derivatives PDE2A, PDE12, PDE5A PDE2A 1/4885PDE10A 10/4885PDE6D 24/4885

“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.