SCHEMBL1341601

SCHEMBL1341601

O=C(Nc1nc(C(=O)O)c(Sc2ccccn2)s1)Nc1ccc(C(F)(F)F)cc1C(=O)C1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SORT1 Q99523 1/20 0.37
LIPC P11150 2/20 0.35
LIPG Q9Y5X9 2/20 0.35
LPL P06858 1/20 0.35
MGLL Q99685 1/20 0.35
RXFP1 Q9HBX9 5/20 0.35
GRIK1 P39086 2/20 0.34
CSNK1D P48730 2/20 0.34
BRAF P15056 3/20 0.34
KDR P35968 3/20 0.34
ALDH1A1 P00352 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL2650860 0.94 CSNK1D (0.38) MAPTATMNPSR1CSNK1DBRAF
SCHEMBL1341472 0.90 AGTR1 (0.41) MAPTALDH1A1ADORA3RAB9AL3MBTL1
SCHEMBL1341915 0.89 GCK (0.37) MAPTATMNPSR1SORT1LIPC
SCHEMBL1342558 0.89 ALDH1A1 (0.38) MAPTALDH1A1ADORA3RAB9AL3MBTL1
SCHEMBL1342405 0.88 GRIK1 (0.39) GRIK1KDRALDH1A1ADORA3RAB9A
SCHEMBL1342469 0.88 MAPT (0.38) MAPTALDH1A1ADORA3RAB9AL3MBTL1
SCHEMBL2650865 0.87 CSNK1D (0.38) MAPTCSNK1DBRAFKDRRAB9A
SCHEMBL1340466 0.87 MGLL (0.38) MAPTATMNPSR1SORT1LIPC
SCHEMBL1341535 0.86 MAPT (0.34) MAPTALDH1A1ADORA3RAB9AL3MBTL1
SCHEMBL1341941 0.86 KMT2A (0.39) MAPTALDH1A1RAB9A

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 MAPT 2678/4885ATM 1245/4885NPSR1 4696/4885
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 MAPT 2678/4885ATM 1245/4885NPSR1 4696/4885
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents GCK, PDK3, PDK4 MAPT 2678/4885ATM 1723/4885NPSR1 4794/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 MAPT 2678/4885ATM 1245/4885NPSR1 4696/4885
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 MAPT 2678/4885ATM 1245/4885NPSR1 4696/4885

“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.