SCHEMBL1341707

SCHEMBL1341707

O=C(Nc1nc(C(=O)O)c(S(=O)(=O)c2nnn[nH]2)s1)Nc1ccc(N2CCOCC2)cc1C(=O)C1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.36
CHRNA4 P43681 1/20 0.36
SLC6A3 Q01959 1/20 0.36
ALDH1A1 P00352 4/20 0.34
IDH1 O75874 1/20 0.34
MAPT P10636 2/20 0.33
TERT O14746 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
LRRK2 Q5S007 2/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NTRK1 P04629 1/20 0.32
NTRK2 Q16620 1/20 0.32
FLT3 P36888 2/20 0.32
ACLY P53396 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL2650589 0.94 GHSR (0.34) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL1342641 0.90 GHSR (0.35) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL2650603 0.88 GHSR (0.34) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL1341471 0.87 AXL (0.39) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL1342406 0.87 GHSR (0.41) GHSRCHRNA4SLC6A3ALDH1A1MAPT
SCHEMBL1341839 0.87 GHSR (0.36) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL1342907 0.86 MAPT (0.34) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL1342842 0.86 GHSR (0.38) GHSRCHRNA4SLC6A3ALDH1A1MAPT
SCHEMBL1341285 0.86 IDH1 (0.37) GHSRCHRNA4SLC6A3ALDH1A1IDH1
SCHEMBL1341294 0.85 ABCC1 (0.34) ALDH1A1MAPTKMT2AMEN1LMNA

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 GHSR 1769/4885CHRNA4 4810/4885SLC6A3 3287/4885
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 GHSR 1769/4885CHRNA4 4810/4885SLC6A3 3287/4885
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents GCK, PDK3, PDK4 GHSR 2575/4885CHRNA4 4830/4885SLC6A3 2967/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 GHSR 1769/4885CHRNA4 4810/4885SLC6A3 3287/4885
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 GHSR 1769/4885CHRNA4 4810/4885SLC6A3 3287/4885

“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.