SCHEMBL6721723

SCHEMBL6721723

CC(C)Cn1c(=O)n(C)c(=O)c2c(Sc3cccs3)c(Cn3cnc4ccccc43)sc21

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.45
PDE1A P54750 4/20 0.45
PDE1B Q01064 4/20 0.45
PDE1C Q14123 4/20 0.45
SLC16A1 P53985 16/20 0.43
CYP2C9 P11712 6/20 0.43
CYP3A4 P08684 2/20 0.43
MAPKAPK2 P49137 1/20 0.41
CAMK2B Q13554 1/20 0.41
HIPK4 Q8NE63 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
SCHEMBL7008659 0.87 SLC16A1 (0.57) PDE2APDE1APDE1BPDE1CSLC16A1
SCHEMBL7011500 0.85 SLC16A1 (0.49) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL6726613 0.81 SLC16A1 (0.47) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL6726116 0.81 SLC16A1 (0.49) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL6726095 0.78 SLC16A1 (0.41) PDE2APDE1APDE1BPDE1CSLC16A1
SCHEMBL7007249 0.76 SLC16A1 (0.47) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B
SCHEMBL7010063 0.76 SLC16A1 (0.69) SLC16A1CYP2C9CYP3A4
SCHEMBL6724379 0.75 SLC16A1 (0.44) SLC16A1CYP2C9MAPKAPK2CAMK2BHIPK4
SCHEMBL6724402 0.75 SLC16A1 (0.75) SLC16A1CYP2C9CYP3A4
SCHEMBL6733690 0.74 SLC16A1 (0.48) SLC16A1CYP2C9CYP3A4MAPKAPK2CAMK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040014634-A1 Thieno[2,3-d]pyrimidinediones and their use as pharmaceuticals ASTRAZENECA AB (SE) 2004-01-22 US claimed
EP-1107973-B1 NOVEL THIENO[2,3-d]PYRIMIDINEDIONES, PROCESS FOR THEIR PREPARATION AND USE THEREOF IN THERAPY ASTRAZENECA AB (SE) 2003-11-05 EP claimed
EP-1280806-A1 THIENO 2,3-d]PYRIMIDINEDIONES AND THEIR USE AS PHARMACEUTICALS AstraZeneca AB (SE) 2003-02-05 EP claimed
WO-2001083489-A1 THIENO[2,3-d]PYRIMIDINEDIONES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2001-11-08 WO claimed
US-6300334-B1 DRUGS FOR TREATMENT OF RESPIRATORY SYSTEM DISORDERS ASTRAZENECA AB (SE) 2001-10-09 US claimed
EP-1107973-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2001-06-20 EP claimed
WO-2000012514-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2000-03-09 WO claimed
US-20040014634-A1 Thieno[2,3-d]pyrimidinediones and their use as pharmaceuticals ASTRAZENECA AB (SE) 2004-01-22 US disclosed
EP-1107973-B1 NOVEL THIENO[2,3-d]PYRIMIDINEDIONES, PROCESS FOR THEIR PREPARATION AND USE THEREOF IN THERAPY ASTRAZENECA AB (SE) 2003-11-05 EP disclosed
EP-1280806-A1 THIENO 2,3-d]PYRIMIDINEDIONES AND THEIR USE AS PHARMACEUTICALS AstraZeneca AB (SE) 2003-02-05 EP disclosed
WO-2001083489-A1 THIENO[2,3-d]PYRIMIDINEDIONES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2001-11-08 WO disclosed
US-6300334-B1 DRUGS FOR TREATMENT OF RESPIRATORY SYSTEM DISORDERS ASTRAZENECA AB (SE) 2001-10-09 US disclosed
EP-1107973-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2001-06-20 EP disclosed
WO-2000012514-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2000-03-09 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-20040014634-A1 Thieno[2,3-d]pyrimidinediones and their use as pharmaceuticals DPYD, TYMP, TYMS PDE2A 478/4885PDE1A 2691/4885PDE1B 1866/4885

“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.