SCHEMBL1240565

SCHEMBL1240565

COCCOC1CCC(N(CCC(C)C)C(=O)Nc2ncc(SCC(=O)O)s2)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 12/20 0.38
CDK2 P24941 12/20 0.38
CCNE2 O96020 11/20 0.38
CDK1 P06493 8/20 0.38
CDK4 P11802 8/20 0.38
CCNB2 O95067 7/20 0.38
CCNB1 P14635 7/20 0.38
CCND1 P24385 7/20 0.38
CCNB3 Q8WWL7 7/20 0.38
GCK P35557 2/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
CD38 P28907 1/20 0.34
TP53 P04637 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL1240562 1.00 CCNE1 (0.38) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1238553 0.93 CDK2 (0.40) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1238550 0.93 CDK2 (0.40) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1240352 0.89 CCNE1 (0.38) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1240351 0.89 CCNE1 (0.38) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1241153 0.87 CCNE2 (0.37) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1241157 0.87 CCNE2 (0.37) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1240682 0.87 CCNE1 (0.47) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1240680 0.87 CCNE1 (0.47) CCNE1CDK2CCNE2CDK1CDK4
SCHEMBL1241359 0.87 CDK2 (0.42) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586614-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-11-19 US disclosed
EP-2377856-A1 Urea glucokinase activators NOVO NORDISK A/S (DK) 2011-10-19 EP disclosed
US-20110077234-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2011-03-31 US disclosed
US-7884210-B2 {2-[3-(2-Cyclohex-1-enyl-ethyl)-3-(trans-4-methyl-cyclohexyl)-ureido]-thiazol-5-ylsulfanyl}-acetic acid; for treatment of type 2 diabetes NOVO NORDISK A/S (DK) 2011-02-08 US disclosed
US-20090105482-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
EP-1904467-A1 UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2008-04-02 EP disclosed
WO-2007006814-A1 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 (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-20090105482-A1 Urea Glucokinase Activators GCK, GCKR, HK2 CCNE1 2561/4885CDK2 268/4885CCNE2 1371/4885
US-20110077234-A1 Urea Glucokinase Activators GCK, GCKR, HK2 CCNE1 2561/4885CDK2 268/4885CCNE2 1371/4885

“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.