SCHEMBL3828070

SCHEMBL3828070

CCOC(=O)c1c(Cc2ccnc3ccccc23)sc2c1c(=O)n(C)c(=O)n2CC(C)C

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC16A1 P53985 20/20 0.72
CYP2C9 P11712 11/20 0.68
CYP3A4 P08684 8/20 0.68
SLC16A7 O60669 1/20 0.68
MAPKAPK2 P49137 1/20 0.48
CAMK2B Q13554 1/20 0.48
HIPK4 Q8NE63 1/20 0.48

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
SCHEMBL4845192 0.94 SLC16A1 (0.69) SLC16A1CYP2C9CYP3A4SLC16A7MAPKAPK2
SCHEMBL4797256 0.92 SLC16A1 (0.60) SLC16A1CYP2C9CYP3A4SLC16A7MAPKAPK2
SCHEMBL4803047 0.91 SLC16A1 (0.59) SLC16A1CYP2C9CYP3A4SLC16A7MAPKAPK2
SCHEMBL4801206 0.89 SLC16A1 (0.57) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL5138945 0.88 SLC16A1 (0.56) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL4797275 0.88 SLC16A1 (0.58) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL4847425 0.87 SLC16A1 (0.75) SLC16A1CYP2C9CYP3A4SLC16A7MAPKAPK2
SCHEMBL4796666 0.85 SLC16A1 (0.70) SLC16A1CYP2C9CYP3A4SLC16A7MAPKAPK2
SCHEMBL4804329 0.85 SLC16A1 (0.54) SLC16A1CYP2C9CYP3A4SLC16A7
SCHEMBL5864836 0.83 SLC16A1 (0.54) SLC16A1CYP2C9CYP3A4SLC16A7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414825-B9 THIENOPYRIMIDINEDIONES AND THEIR USE IN THE MODULATION OF AUTOIMMUNE DISEASE ASTRAZENECA AB (SE) 2009-09-16 EP disclosed
US-20080207642-A1 Thienopyrimidinediones and Their Use in the Modulation of Autoimmune Disease ASTRAZENECA AB (SE) 2008-08-28 US disclosed
US-20080153855-A1 Thieno[2,3-d]pyrimidinedione derivatives; antiproliferative agents against T-cells; chronic obstructive pulmonary disease, asthma; immunosuppressants, antihistamines, bronchodilator agents, and anticarcinogenic agents ASTRAZENECA AB, A SWEDEN CORPORATION 2008-06-26 US disclosed
US-7384950-B2 Thienopyrimidinediones and their use in the modulation of autoimmune disease ASTRAZENECA AB (SE) 2008-06-10 US disclosed
US-7361660-B2 Chemical compounds ASTRAZENECA AB (SE) 2008-04-22 US disclosed
EP-1414825-B1 THIENOPYRIMIDINEDIONES AND THEIR USE IN THE MODULATION OF AUTOIMMUNE DISEASE ASTRAZENECA AB (SE) 2007-09-26 EP disclosed
EP-1412362-B1 THIENO¬2,3-d|PYRIMIDINEDIONES AS INHIBITORS OF T-CELLS PROLIFERATION ASTRAZENECA AB (SE) 2006-08-02 EP disclosed
US-20040254198-A1 Thienopyrimidinediones and their use in the modulation of autoimmune disease ASTRAZENECA AB (SE) 2004-12-16 US disclosed
US-20040171623-A1 Chemical compounds ASTRAZENECA AB (SE) 2004-09-02 US 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 (4 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-20080153855-A1 Thieno[2,3-d]pyrimidinedione derivatives; antiproliferative agents against T-cells; chronic obstructive pulmonary disease, asthma; immunosuppressants, antihistamines, bronchodilator agents, and anticarcinogenic agents HRH4, HRH2, HRH3 SLC16A1 4716/4885CYP2C9 682/4885CYP3A4 397/4885
US-20040171623-A1 Chemical compounds CBR1, SETDB1, CBR3 SLC16A1 1397/4885CYP2C9 63/4885CYP3A4 60/4885
US-20040254198-A1 Thienopyrimidinediones and their use in the modulation of autoimmune disease TPMT, CBR1, CYP2D6 SLC16A1 3284/4885CYP2C9 89/4885CYP3A4 93/4885
US-20080207642-A1 Thienopyrimidinediones and Their Use in the Modulation of Autoimmune Disease C5, TPMT, C9 SLC16A1 3369/4885CYP2C9 71/4885CYP3A4 103/4885

“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.