SCHEMBL7899394

SCHEMBL7899394

Cc1cc2c(cc1C(=O)N1CCc3ccc(Cl)cc3C1)[nH]c(=O)c1cnc(C3CCOCC3)n12

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 8/20 0.47
PDE5A O76074 1/20 0.47
PDE1A P54750 2/20 0.37
PDE1B Q01064 2/20 0.37
PDE1C Q14123 2/20 0.37
SPR P35270 3/20 0.37
ENPP2 Q13822 1/20 0.36
FASN P49327 1/20 0.35

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
SCHEMBL12045035 0.97 PDE9A (0.47) PDE9APDE5APDE1APDE1BPDE1C
SCHEMBL1721457 0.94 PDE9A (0.48) PDE9APDE5APDE1APDE1BPDE1C
SCHEMBL12044995 0.93 PDE9A (0.45) PDE9APDE5APDE1APDE1BPDE1C
SCHEMBL14828364 0.92 PDE9A (0.44) PDE9APDE5APDE1APDE1BPDE1C
SCHEMBL7912411 0.91 PDE9A (0.45) PDE9APDE5APDE1BSPRENPP2
SCHEMBL7908379 0.91 PDE9A (0.43) PDE9APDE5APDE1APDE1BPDE1C
SCHEMBL12045005 0.91 PDE9A (0.43) PDE9APDE5APDE1BSPRENPP2
SCHEMBL7896928 0.91 PDE9A (0.45) PDE9APDE5ASPR
SCHEMBL7908777 0.90 PDE9A (0.45) PDE9APDE5APDE1APDE1BPDE1C
SCHEMBL7909215 0.89 PDE9A (0.45) PDE9APDE5APDE1APDE1BPDE1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130085134-A1 QUINOXALINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-04-04 US disclosed
US-20130085134-A1 QUINOXALINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-04-04 US disclosed
US-8357688-B2 Substituted imidazo[1,5-a]quinoxalin-4(5H)-ones as PDE9 inhibitors ASTELLAS PHARMA INC. (JP) 2013-01-22 US disclosed
US-8357688-B2 Substituted imidazo[1,5-a]quinoxalin-4(5H)-ones as PDE9 inhibitors ASTELLAS PHARMA INC. (JP) 2013-01-22 US disclosed
EP-2404922-A1 QUINOXALINE COMPOUNDS Astellas Pharma Inc. (JP) 2012-01-11 EP disclosed
US-20110319385-A1 QUINOXALINE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-12-29 US disclosed
US-20110319385-A1 QUINOXALINE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-12-29 US disclosed
WO-2010101230-A1 QUINOXALINE COMPOUNDS アステラス製薬株式会社 (JP) 2010-09-10 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-20130085134-A1 QUINOXALINE COMPOUND PDE9A, PDE2A, PDE3A PDE9A 1/4885PDE5A 4/4885PDE1A 36/4885
US-20110319385-A1 QUINOXALINE COMPOUND PDE9A, PDE5A, PDE3A PDE9A 1/4885PDE5A 2/4885PDE1A 51/4885

“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.