SCHEMBL1794002

SCHEMBL1794002

COCCN(C(=O)OC(C)(C)C)c1ccc(N)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.40
OXTR P30559 4/20 0.38
AVPR1A P37288 2/20 0.38
AVPR2 P30518 1/20 0.37
MTOR P42345 5/20 0.35
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 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
SCHEMBL1099319 0.87 F2 (0.37) F2ALOX5APFEN1HDAC1HDAC6
SCHEMBL6040385 0.87 TP53 (0.35) F2ALOX5APFEN1HDAC1HDAC6
SCHEMBL1097728 0.84 MLYCD (0.39) F2OXTRALOX5APFEN1HDAC1
SCHEMBL3822535 0.83 OXTR (0.43) OXTRAVPR1AAVPR2MTORHDAC1
SCHEMBL1794562 0.81 F2 (0.39) F2OXTRAVPR1AAVPR2HDAC1
SCHEMBL18291311 0.79 HDAC1 (0.34) F2ALOX5APFEN1HDAC1HDAC6
SCHEMBL1009548 0.79 F2 (0.37) F2OXTRAVPR1AAVPR2KDM4E
SCHEMBL22544386 0.78 PIK3CA (0.38) MTORALOX5APFEN1PIK3CA
SCHEMBL18291249 0.78 GABRP (0.40) F2MTORHDAC1HDAC6GABRP
SCHEMBL2664537 0.78 HCAR3 (0.45) F2KDM4EALDH1A1MEN1KMT2A

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 40 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-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
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US 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
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
EP-1669069-A1 Compounds effecting glukokinase AstraZeneca AB (SE) 2006-06-14 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-1661563-A1 Compound 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-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 F2 1217/4885OXTR 2623/4885AVPR1A 983/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 F2 1217/4885OXTR 2623/4885AVPR1A 983/4885

“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.