SCHEMBL641050

SCHEMBL641050

CCCCCC(C(N)=O)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.42
CA2 P00918 1/20 0.42
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
GPR84 Q9NQS5 3/20 0.38
FFAR1 O14842 1/20 0.38
EPHX1 P07099 1/20 0.38
BCHE P06276 1/20 0.37
MAPT P10636 1/20 0.37
TP53 P04637 1/20 0.37
LAP3 P28838 1/20 0.37

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
SCHEMBL11571824 0.98 LCK (0.44) CA1CA2LCKPPARDZDHHC20
SCHEMBL28562560 0.98 LCK (0.44) CA1CA2LCKPPARDZDHHC20
SCHEMBL9245067 0.94 CA2 (0.48) CA1CA2LCKPPARDZDHHC20
SCHEMBL4537552 0.91 LCK (0.42) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL27719303 0.90 EPHX1 (0.44) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL11010077 0.90 EPHX1 (0.44) LCKPPARDZDHHC20ZDHHC2EPHX1
SCHEMBL771953 0.88 EPHX1 (0.37) CA1CA2EPHX1
SCHEMBL1478219 0.87 CA1 (0.46) CA1CA2EPHX1BCHE
SCHEMBL1478217 0.87 CA1 (0.46) CA1CA2EPHX1BCHE
SCHEMBL4188387 0.86 CA1 (0.38) CA1CA2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102256952-B Arylcyclopropylacetamide derivatives useful as glucokinase activators LILLY CO ELI 2013-12-11 CN disclosed
EP-2379517-B1 Arylcyclopropylacetamide derivatives useful as glucokinase activators LILLY CO ELI (US) 2013-08-28 EP disclosed
US-8314247-B2 Hydrazone derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-11-20 US disclosed
US-8119626-B2 Oxime derivative and preparations thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-02-21 US disclosed
CN-102256952-A Arylcyclopropylacetamide derivatives useful as glucokinase activators LILLY CO ELI 2011-11-23 CN disclosed
US-20100099662-A1 HYDRAZONE DERIVATIVE MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-04-22 US disclosed
US-20090291936-A1 OXIME DERIVATIVE AND PREPARATIONS THEREOF SUGAWARA KAZUTOSHI 2009-11-26 US disclosed
EP-2105435-A1 HYDRAZONE DERIVATIVE Mitsubishi Tanabe Pharma Corporation (JP) 2009-09-30 EP disclosed
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 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
EP-1907387-A1 AN OXIME DERIVATIVE AND PREPARATIONS THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2008-04-09 EP disclosed
WO-2007007886-A1 AN OXIME DERIVATIVE AND PREPARATIONS THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-01-18 WO disclosed
US-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY 2006-05-25 US 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-20080132479-A1 Oxime Derivative and Preparations Thereof GCK, KHK, GCKR CA1 1515/4885CA2 455/4885LCK 695/4885
US-20090291936-A1 OXIME DERIVATIVE AND PREPARATIONS THEREOF GCK, KHK, GCKR CA1 1515/4885CA2 455/4885LCK 695/4885
US-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators GCK, GCKR, GALK1 CA1 3133/4885CA2 1004/4885LCK 1376/4885
US-20100099662-A1 HYDRAZONE DERIVATIVE GCK, GCKR, HK1 CA1 1315/4885CA2 351/4885LCK 837/4885

“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.