SCHEMBL1016624

SCHEMBL1016624

c1cnc2c(c1)ncc1cncn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LCK P06239 2/20 0.35
HRH4 Q9H3N8 1/20 0.34
TBXAS1 P24557 3/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
PABPC1 P11940 1/20 0.33
KMT2A Q03164 1/20 0.33
GABRA1 P14867 1/20 0.33
HTR3E A5X5Y0 2/20 0.32
HTR3B O95264 2/20 0.32
HTR1A P08908 2/20 0.32
HTR2C P28335 2/20 0.32
HTR3A P46098 2/20 0.32

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
SCHEMBL17254458 0.76 KDM4E (0.58) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29895259 0.75 CYP11B2 (0.41) GABRA5ALDH1A1KDM4ELCKTBXAS1
SCHEMBL970053 0.74 KDM4E (0.59) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29742732 0.74 KDM4E (0.59) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL3320683 0.74 HRH4 (0.36) GABRA5ALDH1A1KDM4ELCKHRH4
SCHEMBL10681757 0.71 GABRA5 (0.36) GABRA5ALDH1A1KDM4EGLAGAA
SCHEMBL15471902 0.70 HRH4 (0.45) ALDH1A1KDM4EHSD17B10HRH4MEN1
SCHEMBL31060458 0.70 LCK (0.40) GABRA5LCKHRH4HTR3EHTR3B
SCHEMBL4038518 0.70 LCK (0.41) GABRA5LCKHRH4HTR3EHTR3B
SCHEMBL31307208 0.69 KDM4E (0.37) GABRA5ALDH1A1KDM4EGLAGAA

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 21 patents — showing the first 20. 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 disclosed
EP-2227472-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 Elbion Gmbh (DE) 2010-09-15 EP disclosed
EP-2225248-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-A]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 Wyeth LLC (US) 2010-09-08 EP disclosed
US-20090239874-A1 Pyrido[3,2-e]pyrazines, their use as inhibitors of phospohodiesterase 10, and processes for preparing them HOFGEN NORBERT 2009-09-24 US disclosed
US-7550465-B2 Pyrido[3,2-e]pyrazines, their use as inhibitors of phosphodiesterase 10, and processes for preparing them ELBION GMBH (DE) 2009-06-23 US 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
WO-2009068246-A2 METHODS OF TREATING OBESITY AND METABOLIC DISORDERS ELBION GMBH (DE) 2009-06-04 WO disclosed
WO-2009068246-A2 METHODS OF TREATING OBESITY AND METABOLIC DISORDERS ELBION GMBH (DE) 2009-06-04 WO disclosed
WO-2009070584-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-A]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 WYETH (US) 2009-06-04 WO disclosed
US-20090143392-A1 Methods of Treating Obesity and Metabolic Disorders 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-20090143367-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-a]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 ELBION GMBH (DE) 2009-06-04 US disclosed
WO-2009068320-A1 ARYL AND HETEROARYL FUSED IMIDAZO (1,5-A) PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 ELBION GMBH (DE) 2009-06-04 WO disclosed
US-20090143391-A1 Aryl and heteroaryl fused imidazo [1,5-a] pyrazines as inhibitors of phosphodiesterase 10 ELBION GMBH (DE) 2009-06-04 US disclosed
EP-2021342-A1 PYRIDO[3,2-e]PYRAZINES, THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10, AND PROCESSES FOR PREPARING THEM Elbion Gmbh (DE) 2009-02-11 EP disclosed
EP-2021341-A1 4-AMINO-PYRIDOÝ3,2-e¨PYRAZINES, THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10, AND PROCESSES FOR PREPARING THEM Elbion Gmbh (DE) 2009-02-11 EP disclosed
US-20080027064-A1 Pyrido[3,2-e]pyrazines, their use as inhibitors of phosphodiesterase 10, and processes for preparing them ELBION GMBH (DE) 2008-01-31 US disclosed
US-20070299079-A1 4-AMINO-PYRIDO[3,2-e]PYRAZINES, THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10, AND PROCESSES FOR PREPARING THEM ELBION AG (DE) 2007-12-27 US disclosed
WO-2007137820-A1 PYRIDO[3,2-e]PYRAZINES, THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10, AND PROCESSES FOR PREPARING THEM ELBION GMBH (DE) 2007-12-06 WO disclosed
WO-2007137819-A1 4-AMINO-PYRIDO[3,2-e]PYRAZINES, THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10, AND PROCESSES FOR PREPARING THEM ELBION GMBH (DE) 2007-12-06 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 (7 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 GABRA5 2231/4885ALDH1A1 1079/4885KDM4E 790/4885
US-20080027064-A1 Pyrido[3,2-e]pyrazines, their use as inhibitors of phosphodiesterase 10, and processes for preparing them PDE12, PDE7A, PDE5A GABRA5 1135/4885ALDH1A1 1084/4885KDM4E 1036/4885
US-20090143391-A1 Aryl and heteroaryl fused imidazo [1,5-a] pyrazines as inhibitors of phosphodiesterase 10 PDE12, PDE5A, PDE10A GABRA5 550/4885ALDH1A1 409/4885KDM4E 1377/4885
US-20090239874-A1 Pyrido[3,2-e]pyrazines, their use as inhibitors of phospohodiesterase 10, and processes for preparing them PDE7A, PDE12, PNPO GABRA5 1312/4885ALDH1A1 1239/4885KDM4E 1334/4885
US-20090143367-A1 ARYL AND HETEROARYL FUSED IMIDAZO[1,5-a]PYRAZINES AS INHIBITORS OF PHOSPHODIESTERASE 10 PDE12, PDE5A, PDE10A GABRA5 550/4885ALDH1A1 409/4885KDM4E 1377/4885
US-20090143392-A1 Methods of Treating Obesity and Metabolic Disorders PDE12, PDE2A, PDE5A GABRA5 2095/4885ALDH1A1 677/4885KDM4E 1088/4885
US-20070299079-A1 4-AMINO-PYRIDO[3,2-e]PYRAZINES, THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10, AND PROCESSES FOR PREPARING THEM PDE12, PDE5A, PDE7A GABRA5 1058/4885ALDH1A1 855/4885KDM4E 580/4885

“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.