SCHEMBL2344461

SCHEMBL2344461

CC(C)c1nc(Cl)nc(-c2ccc(F)cc2)c1I

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.40
MAPK14 Q16539 6/20 0.40
MAPK13 O15264 2/20 0.40
MAPK12 P53778 2/20 0.40
MAPK11 Q15759 2/20 0.40
TXN P10599 1/20 0.37
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
MAPK10 P53779 2/20 0.35
MAPK9 P45984 1/20 0.35
CSNK1D P48730 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
SCHEMBL2347107 0.84 GCGR (0.42) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL15481449 0.83 GCGR (0.41) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL4462472 0.83 GCGR (0.48) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL2342292 0.81 ADORA2A (0.45) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL2343803 0.81 GCGR (0.43) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL4453078 0.81 GCGR (0.40) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL2342322 0.81 GCGR (0.40) GCGRMAPK14MAPK13MAPK12MAPK11
SCHEMBL4449474 0.80 GCGR (0.63) GCGR
SCHEMBL27885298 0.80 GCGR (0.49) GCGR
SCHEMBL27885299 0.79 GCGR (0.39) GCGRMAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101084197-B Process for the preparation of rosuvastatin ASTRAZENECA UK LTD 2012-06-13 CN claimed
EP-2361906-A1 Process for preparing rosuvastatin AstraZeneca UK Limited (GB) 2011-08-31 EP claimed
US-20080207903-A1 Chemical Process ASTRAZENECA UK LIMITED (GB) 2008-08-28 US claimed
EP-1871747-A2 PROCESS FOR PREPARING ROSUVASTATIN AstraZeneca UK Limited (GB) 2008-01-02 EP claimed
CN-101084197-A Process for the preparation of rosuvastatin ASTRAZENECA UK LTD (GB) 2007-12-05 CN claimed
WO-2006067456-A2 PROCESS FOR PREPARING ROSUVASTATIN ASTRAZENECA UK LIMITED (GB) 2006-06-29 WO claimed
CN-101084197-B Process for the preparation of rosuvastatin ASTRAZENECA UK LTD 2012-06-13 CN disclosed
US-8034932-B2 Hydroxy-3-methylglutaryl/3-/ coenzyme A reductase inhibitor; anticholesterol agents;dyslipidemia; chemical intermediate for rosuvastatin ASTRAZENECA UK LIMITED (GB) 2011-10-11 US disclosed
EP-2361906-A1 Process for preparing rosuvastatin AstraZeneca UK Limited (GB) 2011-08-31 EP disclosed
US-20080207903-A1 Chemical Process ASTRAZENECA UK LIMITED (GB) 2008-08-28 US disclosed
EP-1871747-A2 PROCESS FOR PREPARING ROSUVASTATIN AstraZeneca UK Limited (GB) 2008-01-02 EP disclosed
CN-101084197-A Process for the preparation of rosuvastatin ASTRAZENECA UK LTD (GB) 2007-12-05 CN disclosed
WO-2006067456-A2 PROCESS FOR PREPARING ROSUVASTATIN ASTRAZENECA UK LIMITED (GB) 2006-06-29 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-20080207903-A1 Chemical Process CYP2C9, CYP2B6, CYP7A1 GCGR 3195/4885MAPK14 173/4885MAPK13 408/4885

“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.