SCHEMBL2984842

SCHEMBL2984842

CCn1c(=O)[nH]c2ncn(Cc3ccc(OC)cc3)c2c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNOT7 Q9UIV1 3/20 0.54
PARN O95453 1/20 0.54
BRD4 O60885 4/20 0.50
GRIN1 Q05586 2/20 0.45
GRIN2B Q13224 2/20 0.45
ADORA2A P29274 1/20 0.45
ADORA2B P29275 1/20 0.45
ADORA1 P30542 1/20 0.45
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
MTOR P42345 1/20 0.44
KDM4E B2RXH2 2/20 0.44
BRD2 P25440 1/20 0.43
BRD3 Q15059 1/20 0.43
BRDT Q58F21 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
PDE5A O76074 1/20 0.42

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
SCHEMBL2993196 0.99 CNOT7 (0.53) CNOT7PARNBRD4GRIN1GRIN2B
SCHEMBL13861874 0.87 CNOT7 (0.70) CNOT7PARNBRD4ADORA2AADORA2B
SCHEMBL7397785 0.86 GRIN1 (0.53) CNOT7PARNBRD4GRIN1GRIN2B
SCHEMBL14327687 0.86 CNOT7 (0.53) CNOT7PARNADORA2BMAPTMEN1
SCHEMBL7443281 0.82 CNOT7 (0.46) CNOT7PARNADORA2AMEN1KMT2A
SCHEMBL3621012 0.81 CNOT7 (0.57) CNOT7PARNMEN1KMT2ACYP11B2
SCHEMBL18024115 0.81 GRIN1 (0.52) CNOT7PARNGRIN1GRIN2BKMT2A
SCHEMBL10812168 0.79 PDE4A (0.53) CNOT7PARNBRD4ADORA2AADORA2B
SCHEMBL15293652 0.79 CNOT7 (0.52) CNOT7PARNBRD4MAPTMEN1
SCHEMBL27394380 0.78 GDA (0.48) CNOT7PARNBRD4MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786301-B2 Process for preparing xanthine phosphodiesterase V inhibitors and precursors thereof SCHERING CORPORATION (US) 2010-08-31 US disclosed
US-7786301-B2 Process for preparing xanthine phosphodiesterase V inhibitors and precursors thereof SCHERING CORPORATION (US) 2010-08-31 US disclosed
US-7786301-B2 Process for preparing xanthine phosphodiesterase V inhibitors and precursors thereof SCHERING CORPORATION (US) 2010-08-31 US disclosed
US-7312223-B2 8-Amino-7-phenylmethyl-1-ethyl-3,7-dihydro-3-(2-hydroxyethyl)-purine-2,6-dione derivatives; urogenital, respiratory system, kidney, cardiovascular, autoimmune or brain disorders; angina pectoris, hypertension, restenosis; anticarcinogenic, hypoglycemic, antiischemic, and hypotensive agents; diabetes SCHERING CORPORATION (US) 2007-12-25 US disclosed
US-7312223-B2 8-Amino-7-phenylmethyl-1-ethyl-3,7-dihydro-3-(2-hydroxyethyl)-purine-2,6-dione derivatives; urogenital, respiratory system, kidney, cardiovascular, autoimmune or brain disorders; angina pectoris, hypertension, restenosis; anticarcinogenic, hypoglycemic, antiischemic, and hypotensive agents; diabetes SCHERING CORPORATION (US) 2007-12-25 US disclosed
EP-1509525-B9 PROCESS FOR PREPARING XANTHINE PHOSPHODIESTERASE V INHIBITORS AND PRECURSORS THEREOF SCHERING CORP (US) 2007-10-31 EP disclosed
US-7192962-B2 Xanthine phosphodiesterase V inhibitor polymorphs SCHERING CORPORATION (US) 2007-03-20 US disclosed
US-7192962-B2 Xanthine phosphodiesterase V inhibitor polymorphs SCHERING CORPORATION (US) 2007-03-20 US disclosed
EP-1719772-A1 Process for preparing xanthine phosphodiesterase v inhibitors and precursors thereof SCHERING CORPORATION (US) 2006-11-08 EP disclosed
US-20060205943-A1 Process for preparing xanthine phosphodiesterase V inhibitors and precursers thereof SCHERING CORPORATION 2006-09-14 US disclosed
EP-1509525-B1 PROCESS FOR PREPARING XANTHINE PHOSPHODIESTERASE V INHIBITORS AND PRECURSORS THEREOF SCHERING CORP (US) 2006-08-16 EP disclosed
US-7074923-B2 Process for preparing xanthine phosphodiesterase V inhibitors and precursors thereof SCHERING CORPORATION (US) 2006-07-11 US disclosed
US-20030232987-A1 Process for preparing xanthine phosphodiesterase V inhibitors and precursors thereof SCHERING CORPORATION 2003-12-18 US disclosed
WO-2003101991-A1 XANTHINE PHOSPHODIESTERASE V INHIBITOR POLYMORPHS SCHERING CORPORATION (US) 2003-12-11 WO disclosed
WO-2003101992-A1 PROCESS FOR PREPARING XANTHINE PHOSPHODIESTERASE V INHIBITORS AND PRECURSORS THEREOF SCHERING CORPORATION (US) 2003-12-11 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-20030232987-A1 Process for preparing xanthine phosphodiesterase V inhibitors and precursors thereof PDE7A, PDE5A, PDE4B CNOT7 1265/4885PARN 2124/4885BRD4 2498/4885
US-20060205943-A1 Process for preparing xanthine phosphodiesterase V inhibitors and precursers thereof PDE7A, PDE4B, PDE5A CNOT7 1542/4885PARN 1889/4885BRD4 2362/4885

“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.