SCHEMBL5884082

SCHEMBL5884082

CCc1nc(C2CCCC2)n2nc(-c3ccc(C)cc3)[nH]c(=O)c12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 7/20 0.52
PDE1A P54750 4/20 0.52
PDE1B Q01064 4/20 0.52
PDE1C Q14123 4/20 0.52
KMT2A Q03164 1/20 0.38
TNKS2 Q9H2K2 4/20 0.36
WNT3A P56704 1/20 0.36
TNKS O95271 3/20 0.35
PARP1 P09874 3/20 0.35
KHK P50053 1/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5884434 0.98 PDE5A (0.49) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5883548 0.90 PDE5A (0.51) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5860677 0.90 PDE5A (0.51) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5884060 0.90 PDE5A (0.51) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5884355 0.90 PDE5A (0.55) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5884416 0.89 PDE5A (0.54) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5883869 0.89 PDE5A (0.54) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5847439 0.89 PDE5A (0.43) PDE5APDE1APDE1BPDE1CTNKS2
SCHEMBL6287109 0.89 PDE5A (0.51) PDE5APDE1APDE1BPDE1CKMT2A
SCHEMBL5883903 0.88 PDE5A (0.49) PDE5APDE1APDE1BPDE1CKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087605-B2 5-Ethyl-imidazotriazinones BAYER AKTIENGESELLSCHAFT (DE) 2006-08-08 US disclosed
EP-1397363-B1 5-ETHYL-IMIDAZOTRIAZINONES BAYER HEALTHCARE AG (DE) 2005-05-11 EP disclosed
US-20040254187-A1 5-ethyl-imidazotriazinones BAYER HEALTHCARE AG (DE) 2004-12-16 US disclosed
EP-1397363-A1 5-ETHYL-IMIDAZOTRIAZINONES Bayer HealthCare AG (DE) 2004-03-17 EP disclosed
WO-2002098880-A1 5-ETHYL-IMIDAZOTRIAZINONES BAYER HEALTHCARE AG (DE) 2002-12-12 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 (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-20040254187-A1 5-ethyl-imidazotriazinones EPX, TPMT, IL5 PDE5A 409/4885PDE1A 860/4885PDE1B 1362/4885

“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.