SCHEMBL1340228

SCHEMBL1340228

O=C(Nc1ccnc(C(=O)C2CCCC2)c1)Nc1nc(C(=O)O)c(Cl)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 4/20 0.41
SMARCA4 P51532 3/20 0.41
JAK2 O60674 2/20 0.38
TYK2 P29597 2/20 0.38
RAF1 P04049 1/20 0.37
BRAF P15056 1/20 0.37
CCNE1 P24864 3/20 0.37
CDK2 P24941 3/20 0.37
CDK5 Q00535 3/20 0.37
GRM4 Q14833 1/20 0.36
ANO1 Q5XXA6 1/20 0.36
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
MET P08581 1/20 0.36
KDR P35968 1/20 0.36
MERTK Q12866 1/20 0.36
JAK1 P23458 1/20 0.36
HSD17B10 Q99714 2/20 0.36
GSK3B P49841 1/20 0.35
CSNK2A1 P68400 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
SCHEMBL1342371 0.88 MAPT (0.40) SMARCA2SMARCA4JAK2TYK2RAF1
SCHEMBL1341890 0.85 CCNE1 (0.38) SMARCA2SMARCA4RAF1BRAFCCNE1
SCHEMBL1341109 0.85 SMARCA2 (0.41) SMARCA2SMARCA4JAK2TYK2RAF1
SCHEMBL1340592 0.85 CLK1 (0.39) SMARCA2SMARCA4RAF1BRAFCCNE1
SCHEMBL1340527 0.82 KDR (0.38) SMARCA2SMARCA4CCNE1CDK2CDK5
SCHEMBL1339159 0.81 CCNE1 (0.44) SMARCA2SMARCA4JAK2TYK2CCNE1
SCHEMBL1341736 0.81 MAPT (0.44) SMARCA2SMARCA4JAK2TYK2CCNE1
SCHEMBL1342173 0.81 CCNE1 (0.33) SMARCA2SMARCA4RAF1BRAFCCNE1
SCHEMBL1343480 0.80 GRM4 (0.37) CCNE1CDK2CDK5GRM4EGFR
SCHEMBL1343102 0.80 SMARCA2 (0.41) SMARCA2SMARCA4JAK2TYK2RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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-7897628-B2 {2-[3-(4-Methyl-2-[2-methypropoxy]phenyl)-ureido]-thiazol-4-yl}-acetic acid ethyl ester; glucokinase inhibitor; antidiabetic, hypoglycemic agent; activators of glucokinase NOVO NORDISK A/S (DK) 2011-03-01 US disclosed
US-7541373-B2 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2009-06-02 US disclosed
US-7384967-B2 Aryl carbonyl derivatives as therapeutic agents NOVO NORDISK A/S (DK) 2008-06-10 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
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 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 (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 SMARCA2 3402/4885SMARCA4 3231/4885JAK2 1395/4885
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 SMARCA2 3402/4885SMARCA4 3231/4885JAK2 1395/4885
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents GCK, PDK3, PDK4 SMARCA2 3538/4885SMARCA4 3291/4885JAK2 1913/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 SMARCA2 3402/4885SMARCA4 3231/4885JAK2 1395/4885
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 SMARCA2 3402/4885SMARCA4 3231/4885JAK2 1395/4885

“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.