SCHEMBL1341455

SCHEMBL1341455

Cc1ccc(NC(=O)Nc2ncc(SCCC(=O)O)s2)c(C(=O)C2CCCC2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 10/20 0.40
CCNE1 P24864 9/20 0.40
CCNE2 O96020 8/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
CCNB2 O95067 4/20 0.37
CDK1 P06493 4/20 0.37
CCNB1 P14635 4/20 0.37
CCNB3 Q8WWL7 4/20 0.37
CDK4 P11802 3/20 0.37
CCND1 P24385 3/20 0.37
CDK9 P50750 3/20 0.35
CDK7 P50613 2/20 0.35
ABCC1 P33527 1/20 0.35
CDK5 Q00535 2/20 0.35
CIT O14578 1/20 0.35
CASK O14936 1/20 0.35
AURKA O14965 1/20 0.35
GAK O14976 1/20 0.35
DCLK1 O15075 1/20 0.35
MAP3K7 O43318 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
SCHEMBL1339272 0.91 CDK2 (0.37) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1342199 0.91 CDK2 (0.39) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1340880 0.91 CDK2 (0.39) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1340972 0.91 CDK2 (0.39) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL10315610 0.90 CDK2 (0.38) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL14217623 0.89 CDK2 (0.37) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1340921 0.89 PLK1 (0.41) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1339556 0.89 CDK2 (0.37) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1339817 0.88 CDK2 (0.41) CDK2CCNE1CCNE2SMN1; SMN2CCNB2
SCHEMBL1345877 0.87 JAK3 (0.40) CDK2CCNE1CCNE2SMN1; SMN2CCNB2

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2006-08-17 US claimed
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 US claimed
US-RE45670-E1 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2015-09-15 US disclosed
US-RE45670-E1 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2015-09-15 US disclosed
EP-2471533-A1 Aryl carbonyl derivatives as therapeutic agents Novo Nordisk A/S (DK) 2012-07-04 EP disclosed
EP-2471533-A1 Aryl carbonyl derivatives as therapeutic agents Novo Nordisk A/S (DK) 2012-07-04 EP disclosed
US-20110301158-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2011-12-08 US disclosed
US-20110301158-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2011-12-08 US disclosed
US-8063081-B2 N-(2-Phenoxyphenyl)-N'-(thiazol-2-yl)urea; glucokinase inhibitor; antidiabetic, hypoglycemic agent; activators of glucokinase NOVO NORDISK A/S (DK) 2011-11-22 US disclosed
US-8063081-B2 N-(2-Phenoxyphenyl)-N'-(thiazol-2-yl)urea; glucokinase inhibitor; antidiabetic, hypoglycemic agent; activators of glucokinase NOVO NORDISK A/S (DK) 2011-11-22 US disclosed
US-8063081-B2 N-(2-Phenoxyphenyl)-N'-(thiazol-2-yl)urea; glucokinase inhibitor; antidiabetic, hypoglycemic agent; activators of glucokinase NOVO NORDISK A/S (DK) 2011-11-22 US disclosed
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2008-05-22 US disclosed
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2008-05-22 US disclosed
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2008-05-22 US disclosed
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2008-05-22 US disclosed
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2006-08-17 US disclosed
EP-1531815-A1 GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-05-25 EP disclosed
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 US disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 WO disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 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 (5 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-20110301158-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS GCK, GCKR, PDK2 CDK2 1019/4885CCNE1 4257/4885CCNE2 3785/4885
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 CDK2 1019/4885CCNE1 4257/4885CCNE2 3785/4885
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents GCK, PDK3, PDK4 CDK2 1126/4885CCNE1 4222/4885CCNE2 3444/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 CDK2 1019/4885CCNE1 4257/4885CCNE2 3785/4885
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 CDK2 1019/4885CCNE1 4257/4885CCNE2 3785/4885

“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.