SCHEMBL3330563

SCHEMBL3330563

Cc1nc(-c2ccccc2C(N)=O)n2c1nnc1ccc(Cl)cc12

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 18/20 0.63
PDE2A O00408 17/20 0.63
ESR2 Q92731 1/20 0.47

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
SCHEMBL3321720 0.79 PDE2A (0.83) PDE10APDE2A
SCHEMBL3325670 0.78 PDE2A (0.82) PDE10APDE2A
SCHEMBL3328280 0.78 PDE2A (1.00) PDE10APDE2A
SCHEMBL3321196 0.76 PDE10A (0.75) PDE10APDE2A
SCHEMBL12503095 0.73 PDE2A (1.00) PDE10APDE2A
SCHEMBL12502536 0.73 PDE2A (1.00) PDE10APDE2AESR2
SCHEMBL3325943 0.72 PDE2A (0.65) PDE10APDE2AESR2
SCHEMBL3325586 0.72 PDE2A (0.67) PDE10APDE2A
SCHEMBL3330230 0.71 PDE2A (0.82) PDE10APDE2A
SCHEMBL3321674 0.71 PDE2A (0.86) PDE10APDE2A

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-20100120763-A1 IMIDAZO[5,1-C][1,2,4]BENZOTRIAZINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASES WYETH (US) 2010-05-13 US claimed
US-20100120763-A1 IMIDAZO[5,1-C][1,2,4]BENZOTRIAZINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASES WYETH (US) 2010-05-13 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-20100120763-A1 IMIDAZO[5,1-C][1,2,4]BENZOTRIAZINE DERIVATIVES AS INHIBITORS OF PHOSPHODIESTERASES PDE2A, PDE5A, PDE3A PDE10A 13/4885PDE2A 1/4885ESR2 3561/4885

“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.