SCHEMBL1340568

SCHEMBL1340568

COC(=O)c1c(OC)cccc1Oc1ccccc1[N+](=O)[O-]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.66
ALDH1A1 P00352 6/20 0.59
TDP1 Q9NUW8 2/20 0.59
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
ESR2 Q92731 1/20 0.48
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 1/20 0.46
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ABCC4 O15439 1/20 0.46
PLIN1 O60240 1/20 0.46
CACNA1F O60840 1/20 0.46
GMNN O75496 1/20 0.46
KCNK2 O95069 1/20 0.46
ABCB11 O95342 1/20 0.46
GSR P00390 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL7117316 0.88 L3MBTL1 (0.56) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
SCHEMBL15971486 0.87 TDP1 (0.59) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
SCHEMBL1339532 0.86 L3MBTL1 (0.53) L3MBTL1ALDH1A1TDP1HPGDKMT2A
SCHEMBL8076951 0.81 L3MBTL1 (0.62) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
SCHEMBL1340341 0.81 L3MBTL1 (0.58) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
SCHEMBL1340625 0.80 L3MBTL1 (1.00) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
SCHEMBL11398188 0.78 TDP1 (0.56) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
Methyl 2,6-Dimethoxybenzoate SCHEMBL2095636 0.78 CA12 (0.65) L3MBTL1KMT2AMAPTTSHRMAPK1
SCHEMBL1341803 0.78 L3MBTL1 (0.76) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2
SCHEMBL1340006 0.77 L3MBTL1 (0.75) L3MBTL1ALDH1A1TDP1HPGDSMN1; SMN2

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 13 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
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

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 L3MBTL1 2520/4885ALDH1A1 192/4885TDP1 3398/4885
US-20080119455-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 L3MBTL1 2520/4885ALDH1A1 192/4885TDP1 3398/4885
US-20060183783-A1 Aryl carbonyl derivatives as therapeutic agents GCK, PDK3, PDK4 L3MBTL1 2582/4885ALDH1A1 148/4885TDP1 3616/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 L3MBTL1 2520/4885ALDH1A1 192/4885TDP1 3398/4885
US-20080119454-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 L3MBTL1 2520/4885ALDH1A1 192/4885TDP1 3398/4885

“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.