SCHEMBL2666855

SCHEMBL2666855

CCOC(=O)CCc1cnc(NC(=O)OC(C)(C)C)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
POLB P06746 2/20 0.43
CCNE1 P24864 4/20 0.43
CDK2 P24941 4/20 0.43
CDK1 P06493 3/20 0.43
CDK4 P11802 3/20 0.43
CCNB2 O95067 2/20 0.43
CCNE2 O96020 2/20 0.43
CCNB1 P14635 2/20 0.43
CCND1 P24385 2/20 0.43
CCNB3 Q8WWL7 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
MAPK14 Q16539 2/20 0.41
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
CDK5 Q00535 1/20 0.38
MAPK1 P28482 1/20 0.38
CA1 P00915 1/20 0.38

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
SCHEMBL21222206 0.88 ALDH1A1 (0.62) ALDH1A1TSHRSMN1; SMN2POLBCCNE1
SCHEMBL10233485 0.85 SCD (0.44) ALDH1A1TSHRSMN1; SMN2CCNE1CDK2
SCHEMBL12725091 0.85 FDPS (0.49) ALDH1A1TSHRSMN1; SMN2CCNE1CDK2
SCHEMBL10233501 0.84 SMN1; SMN2 (0.41) ALDH1A1TSHRSMN1; SMN2CCNE1CDK2
SCHEMBL7505598 0.84 CDK2 (0.60) ALDH1A1TSHRSMN1; SMN2POLBCCNE1
SCHEMBL31240467 0.82 MAPK1 (0.45) SMN1; SMN2CCNE1CDK2CDK1CDK4
SCHEMBL8834765 0.82 CCNE1 (0.52) ALDH1A1TSHRSMN1; SMN2CCNE1CDK2
SCHEMBL25251839 0.81 SMN1; SMN2 (0.41) ALDH1A1TSHRSMN1; SMN2L3MBTL1
SCHEMBL1939044 0.81 CA1 (0.45) SMN1; SMN2CCNE1CDK2CDK1CDK4
SCHEMBL6058821 0.81 SMN1; SMN2 (0.43) ALDH1A1TSHRSMN1; SMN2POLBCCNE1

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
US-8119626-B2 Oxime derivative and preparations thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-02-21 US disclosed
US-8119626-B2 Oxime derivative and preparations thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-02-21 US disclosed
US-20090291936-A1 OXIME DERIVATIVE AND PREPARATIONS THEREOF SUGAWARA KAZUTOSHI 2009-11-26 US disclosed
US-20090291936-A1 OXIME DERIVATIVE AND PREPARATIONS THEREOF SUGAWARA KAZUTOSHI 2009-11-26 US disclosed
US-7514439-B2 Oxime derivative and preparations thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-7514439-B2 Oxime derivative and preparations thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-04-07 US disclosed
US-20080132479-A1 Oxime Derivative and Preparations Thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-06-05 US disclosed
US-20080132479-A1 Oxime Derivative and Preparations Thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-06-05 US disclosed
WO-2007007886-A1 AN OXIME DERIVATIVE AND PREPARATIONS THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-01-18 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 (2 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-20080132479-A1 Oxime Derivative and Preparations Thereof GCK, KHK, GCKR ALDH1A1 1936/4885TSHR 448/4885SMN1; SMN2 4216/4885
US-20090291936-A1 OXIME DERIVATIVE AND PREPARATIONS THEREOF GCK, KHK, GCKR ALDH1A1 1936/4885TSHR 448/4885SMN1; SMN2 4216/4885

“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.