SCHEMBL1795449

SCHEMBL1795449

N#Cc1ccccc1COc1cc(O)cc(C(=O)Nc2ccc([N+](=O)[O-])cn2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.48
RARA P10276 1/20 0.48
RARB P10826 1/20 0.48
RARG P13631 1/20 0.48
MAPT P10636 6/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.47
GAA P10253 2/20 0.46
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 1/20 0.43
SPHK2 Q9NRA0 2/20 0.43
POLB P06746 1/20 0.43
SPHK1 Q9NYA1 1/20 0.42
RECQL P46063 1/20 0.41

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
SCHEMBL2666433 0.92 GCK (0.49) GCKRARARARBRARGKMT2A
SCHEMBL1792248 0.90 GCK (0.54) GCKRARARARBRARGMAPT
SCHEMBL1794120 0.90 GCK (0.49) GCKRARARARBRARGMAPT
SCHEMBL5134807 0.86 GCK (0.47) GCKRARARARBRARGMAPT
SCHEMBL2661460 0.83 NPC1 (0.49) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14018651 0.82 GCK (0.54) GCKRARARARBRARGNPC1
SCHEMBL2666435 0.81 GCK (0.48) GCKRARARARBRARGMAPT
SCHEMBL2664858 0.80 GCK (0.57) GCKRARARARBRARGALDH1A1
SCHEMBL1793007 0.80 GCK (0.71) GCKRARARARBRARGMAPT
SCHEMBL2664602 0.77 GCK (0.56) GCKRARARARBRARGKMT2A

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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
EP-1568367-B3 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 EP disclosed
EP-1529530-B3 Compounds affecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 EP disclosed
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
EP-1987831-A1 COMPOUNDS EFFECTING GLUCOKINASE AstraZeneca AB (SE) 2008-11-05 EP disclosed
EP-1987831-A1 COMPOUNDS EFFECTING GLUCOKINASE AstraZeneca AB (SE) 2008-11-05 EP disclosed
EP-1661569-A1 Compounds effecting glucokinase AstraZeneca AB (SE) 2006-05-31 EP disclosed
EP-1661567-A1 Compounds effecting Glucokinase AstraZeneca AB (SE) 2006-05-31 EP disclosed
EP-1661568-A1 Compounds effecting Glucokinase AstraZeneca AB (SE) 2006-05-31 EP disclosed
EP-1661563-A1 Compound effecting Glucokinase AstraZeneca AB (SE) 2006-05-31 EP disclosed
EP-1420784-B1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2006-04-19 EP disclosed
EP-1568367-A1 Compounds effecting glucokinase AstraZeneca AB (SE) 2005-08-31 EP disclosed
EP-1529530-A1 Compounds affecting glucokinase AstraZeneca AB (SE) 2005-05-11 EP disclosed
US-20050080106-A1 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2005-04-14 US disclosed
EP-1420784-A1 COMPOUNDS EFFECTING GLUCOKINASE Astrazeneca AB (SE) 2004-05-26 EP disclosed
WO-2003015774-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2003-02-27 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 (2 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-20050080106-A1 Compounds effecting glucokinase GCKR, GCK, SLC5A2 GCK 2/4885RARA 3925/4885RARB 3902/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 GCK 2/4885RARA 3925/4885RARB 3902/4885

“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.