SCHEMBL2648063

SCHEMBL2648063

CCOC(=O)CSc1cnc(NC(=O)N(C2CCCC2)C2CCC(OC)CC2)s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 9/20 0.59
CDK2 P24941 9/20 0.59
CCNE2 O96020 8/20 0.59
CDK1 P06493 5/20 0.59
CDK4 P11802 5/20 0.59
CCNB2 O95067 4/20 0.59
CCNB1 P14635 4/20 0.59
CCND1 P24385 4/20 0.59
CCNB3 Q8WWL7 4/20 0.59
SMN1; SMN2 Q16637 4/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPK1 P28482 1/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 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
SCHEMBL2648061 1.00 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL999629 0.93 CCNE1 (0.64) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL998855 0.93 CCNE1 (0.64) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL999973 0.93 CCNE1 (0.64) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL2648692 0.91 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1001149 0.91 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL998678 0.91 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL998676 0.91 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1001147 0.91 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL2648697 0.91 CCNE1 (0.59) CCNE1CDK2CCNE2CDK1CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582769-B2 Dicycloalkyl urea glucokinase activators NOVO NORDISK A/S (DK) 2009-09-01 US disclosed
US-20090118501-A1 Dicycloalkyl Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-05-07 US disclosed
EP-1904466-A1 DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2008-04-02 EP disclosed
WO-2007006760-A1 DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 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 (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-20090118501-A1 Dicycloalkyl Urea Glucokinase Activators GCK, GCKR, UCK2 CCNE1 2454/4885CDK2 253/4885CCNE2 2474/4885

“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.