SCHEMBL970421

SCHEMBL970421

Cc1nc(-c2ccccc2)n2c1c(C)nc1ccc(F)cc12

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 14/20 0.71
▸ PDE2A O00408 9/20 0.71
▸ CYP11B2 P19099 4/20 0.45
▸ CYP11B1 P15538 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ PDE7A Q13946 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41

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
SCHEMBL968378 0.89 PDE10A (0.58) PDE10APDE2ACYP11B2CYP11B1ALDH1A1
SCHEMBL970002 0.89 PDE10A (0.58) PDE10APDE2ACYP11B2CYP11B1ALDH1A1
SCHEMBL968956 0.89 PDE10A (0.64) PDE10APDE2ACYP11B2CYP11B1SMN1; SMN2
SCHEMBL971703 0.87 PDE10A (0.69) PDE10APDE2ACYP11B2CYP11B1PDE7A
SCHEMBL972367 0.85 PDE10A (0.60) PDE10APDE2ACYP11B2CYP11B1PDE7A
SCHEMBL971842 0.85 PDE10A (0.67) PDE10APDE2ACYP11B2CYP11B1PDE7A
SCHEMBL3658809 0.85 PDE10A (0.54) PDE10APDE2ACYP11B2CYP11B1ALDH1A1
SCHEMBL970680 0.83 PDE10A (0.58) PDE10APDE2APDE7A
SCHEMBL969614 0.83 PDE10A (1.00) PDE10APDE2APDE7A
SCHEMBL971206 0.83 PDE10A (0.61) PDE10APDE2APDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875618-B2 8-chloro-3,4-dimethyl-1-(2- methylphenyl)imidazo[1,5- a]quinoxaline; inhibitors of phosphodiesterase 10; for treatment of central nervous system disorders (cognitive deficits, social phobia, reduced vigilance, obesity and psychosis) WYETH (US) 2011-01-25 — — US claimed
US-20090143367-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-a]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 ELBION GMBH (DE) 2009-06-04 — — US claimed
US-7875618-B2 8-chloro-3,4-dimethyl-1-(2- methylphenyl)imidazo[1,5- a]quinoxaline; inhibitors of phosphodiesterase 10; for treatment of central nervous system disorders (cognitive deficits, social phobia, reduced vigilance, obesity and psychosis) WYETH (US) 2011-01-25 — — US disclosed
US-20090143367-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-a]PYRAZINES 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-20090143367-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-a]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 PDE12, PDE5A, PDE10A PDE10A 3/4885PDE2A 6/4885CYP11B2 202/4885

“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.

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