SCHEMBL2340089

SCHEMBL2340089

CNc1nc(-c2ccc(F)cc2)c(Cl)c(C(C)C)n1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 8/20 0.48
SCN9A Q15858 1/20 0.44
ADORA2B P29275 3/20 0.36
MAPK14 Q16539 3/20 0.36
GCGR P47871 6/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
TXN P10599 1/20 0.36
NUDT1 P36639 1/20 0.36
ADORA2A P29274 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 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
SCHEMBL527760 0.84 ADORA1 (0.49) ADORA1SCN9AADORA2BMAPK14GCGR
SCHEMBL2339952 0.82 ALOX5 (0.41) SCN9AMAPK14GCGRMAPK13MAPK12
SCHEMBL2340032 0.82 ADORA1 (0.48) ADORA1SCN9AADORA2BMAPK14GCGR
SCHEMBL2344474 0.82 ADORA1 (0.48) ADORA1SCN9AADORA2BMAPK14GCGR
SCHEMBL2347107 0.81 GCGR (0.42) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL16429685 0.81 GCGR (0.57) ADORA1SCN9AGCGR
SCHEMBL7921907 0.80 ADORA1 (0.46) ADORA1SCN9AGCGR
SCHEMBL3082 0.79 ADORA1 (0.45) ADORA1SCN9AGCGR
SCHEMBL2340258 0.79 GCGR (0.43) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL2346398 0.79 ADORA2A (0.45) ADORA1SCN9AADORA2BMAPK14GCGR

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 ADORA1 4310/4885SCN9A 955/4885ADORA2B 4043/4885

“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.