SCHEMBL2657573

SCHEMBL2657573

COc1ccc(CCN(C(=O)Nc2ncc(SCC(C)(C)C(=O)O)s2)[C@H]2CC[C@H](C)CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.40
PPARG P37231 2/20 0.40
PPARD Q03181 2/20 0.40
CDK2 P24941 6/20 0.38
CCNE2 O96020 5/20 0.38
CCNE1 P24864 5/20 0.38
MAPT P10636 2/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CASP1 P29466 1/20 0.35
C5AR1 P21730 1/20 0.34
CCNB2 O95067 2/20 0.34
CDK1 P06493 2/20 0.34
CDK4 P11802 2/20 0.34
CCNB1 P14635 2/20 0.34
CCND1 P24385 2/20 0.34
CCNB3 Q8WWL7 2/20 0.34
ITK Q08881 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL1241347 1.00 PPARA (0.40) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL12751228 0.93 PPARG (0.39) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL1241460 0.93 PPARG (0.39) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL12204778 0.93 PPARA (0.47) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL2658053 0.91 CDK2 (0.48) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL1241543 0.91 CDK2 (0.48) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL2658972 0.89 PPARA (0.44) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL2658974 0.89 PPARA (0.44) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL2668705 0.89 GCK (0.43) PPARAPPARGPPARDCDK2CCNE2
SCHEMBL1238617 0.89 GCK (0.43) PPARAPPARGPPARDCDK2CCNE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041711-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2010-02-18 US claimed
EP-2099777-A1 UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2009-09-16 EP claimed
WO-2008084044-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2008-07-17 WO claimed
US-8586614-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-11-19 US disclosed
US-8362049-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-01-29 US disclosed
US-8362049-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-01-29 US disclosed
US-8318778-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2012-11-27 US disclosed
US-8318778-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2012-11-27 US disclosed
US-20120165375-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2012-06-28 US disclosed
US-20120165375-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2012-06-28 US 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-20100041711-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2010-02-18 US disclosed
US-20100041711-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2010-02-18 US disclosed
EP-2099777-A1 UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2009-09-16 EP disclosed
US-20090105482-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
WO-2008084044-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2008-07-17 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 (4 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 PPARA 2109/4885PPARG 844/4885PPARD 1805/4885
US-20110077234-A1 Urea Glucokinase Activators GCK, GCKR, HK2 PPARA 2109/4885PPARG 844/4885PPARD 1805/4885
US-20100041711-A1 Urea Glucokinase Activators GCK, GCKR, HK2 PPARA 1441/4885PPARG 623/4885PPARD 1230/4885
US-20120165375-A1 Urea Glucokinase Activators GCK, GCKR, HK2 PPARA 1441/4885PPARG 623/4885PPARD 1230/4885

“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.