SCHEMBL1342018

SCHEMBL1342018

O=C(Nc1ncc(S(=O)(=O)c2ncc[nH]2)s1)Nc1ccc(F)cc1C(=O)C1CCCC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
CCNE1 P24864 6/20 0.33
CDK2 P24941 6/20 0.33
CDK5 Q00535 6/20 0.33
NPC1 O15118 2/20 0.33
POLB P06746 2/20 0.33
RAB9A P51151 2/20 0.33
GCK P35557 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
IDH2 P48735 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
DGAT1 O75907 1/20 0.32
AGTR1 P30556 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
HTR6 P50406 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
SCHEMBL2651273 0.94 KDR (0.36)
SCHEMBL1342141 0.91 SIRT4 (0.35) CCNE1CDK2CDK5NPC1POLB
SCHEMBL1340577 0.91 SMN1; SMN2 (0.36) LMNATP53CCNE1CDK2CDK5
SCHEMBL1342398 0.90 KDR (0.36) IDH2
SCHEMBL1341268 0.90 CCNE1 (0.38) TP53CCNE1CDK2CDK5SMN1; SMN2
SCHEMBL1343229 0.89 MAPT (0.40) NPC1RAB9A
SCHEMBL1340110 0.89 MAPT (0.33) TP53CCNE1CDK2CDK5SMN1; SMN2
SCHEMBL1342333 0.88 CCNE1 (0.39) CCNE1CDK2CDK5SMN1; SMN2IDH2
SCHEMBL1342328 0.87 CCNE1 (0.39) CCNE1CDK2CDK5SMN1; SMN2IDH2
SCHEMBL1342422 0.86 CDK2 (0.34) LMNATP53CCNE1CDK2CDK5

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 LMNA 4011/4885TP53 2961/4885CCNE1 4257/4885
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 LMNA 4011/4885TP53 2961/4885CCNE1 4257/4885
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents GCK, PDK3, PDK4 LMNA 3933/4885TP53 3181/4885CCNE1 4222/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 LMNA 4011/4885TP53 2961/4885CCNE1 4257/4885
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 LMNA 4011/4885TP53 2961/4885CCNE1 4257/4885

“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.