SCHEMBL1178769

SCHEMBL1178769

Cc1cc(-c2cc(C(=O)N(C)C)no2)cc2c1C(=O)N(C(C)C)C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 17/20 0.43
PIK3CD O00329 3/20 0.40
PIK3R1 P27986 3/20 0.40
PIK3CA P42336 2/20 0.40
PIK3CB P42338 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
STK17A Q9UEE5 1/20 0.40
KCNH2 Q12809 2/20 0.40
S1PR1 P21453 1/20 0.36

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
SCHEMBL1179232 0.89 PIK3CG (0.41) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL1178514 0.89 PIK3CG (0.57) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL1178771 0.81 PIK3CG (0.55) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL16457079 0.79 PIK3CG (0.38) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL1178349 0.79 PIK3CG (0.52) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
Azd-8418 SCHEMBL1178353 0.78 PIK3CG (0.71) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
Azd-8418 SCHEMBL30795783 0.78 PIK3CG (0.71) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL1178552 0.78 PIK3CG (0.51) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL1685904 0.77 PIK3CG (0.59) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB
SCHEMBL4564872 0.77 PIK3CG (0.59) PIK3CGPIK3CDPIK3R1PIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148372-B2 Metabotropic glutamate receptor isoxazole ligands and their use as potentiators—286 ASTRAZENECA AB (SE) 2012-04-03 US claimed
US-20100317662-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators - 286 CACCIOLA JOSEPH 2010-12-16 US claimed
EP-2772492-B1 Use of an isoxazole derivative for the treatment of withdrawal symptom ASTRAZENECA AB (SE) 2016-08-17 EP disclosed
EP-2772492-B1 Use of an isoxazole derivative for the treatment of withdrawal symptom ASTRAZENECA AB (SE) 2016-08-17 EP disclosed
EP-2772492-A1 Use of an isoxazole derivative for the treatment of withdrawal symptom AstraZeneca AB (SE) 2014-09-03 EP disclosed
EP-2772492-A1 Use of an isoxazole derivative for the treatment of withdrawal symptom AstraZeneca AB (SE) 2014-09-03 EP disclosed
EP-2303872-B1 ISOXAZOLE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2014-04-16 EP disclosed
US-8148372-B2 Metabotropic glutamate receptor isoxazole ligands and their use as potentiators—286 ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148372-B2 Metabotropic glutamate receptor isoxazole ligands and their use as potentiators—286 ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-8148372-B2 Metabotropic glutamate receptor isoxazole ligands and their use as potentiators—286 ASTRAZENECA AB (SE) 2012-04-03 US disclosed
EP-2303872-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2011-04-06 EP disclosed
US-7781434-B2 Metabotropic glutamate receptor isoxazole ligands and their use as potentiators—286 ASTRAZENECA AB (SE) 2010-08-24 US disclosed
US-20100022545-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators - 286 CACCIOLA JOSEPH 2010-01-28 US disclosed
US-20100022545-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators - 286 CACCIOLA JOSEPH 2010-01-28 US disclosed
US-20100022545-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators - 286 CACCIOLA JOSEPH 2010-01-28 US disclosed
WO-2009148403-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2009-12-10 WO disclosed
WO-2009148403-A1 ISOXAZOLE DERIVATIVES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2009-12-10 WO disclosed
US-20090306158-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators 286 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
US-20090306158-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators 286 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
US-20090306158-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators 286 ASTRAZENECA AB (SE) 2009-12-10 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 (3 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-20100022545-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators - 286 GRM1, GRM3, GRIN1 PIK3CG 2627/4885PIK3CD 2609/4885PIK3R1 1292/4885
US-20090306158-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators 286 GRM1, GRM3, GRIN1 PIK3CG 2539/4885PIK3CD 2563/4885PIK3R1 1142/4885
US-20100317662-A1 Metabotropic Glutamate Receptor Isoxazole Ligands and Their Use as Potentiators - 286 GRM1, GRM3, GRIN1 PIK3CG 2627/4885PIK3CD 2609/4885PIK3R1 1292/4885

“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.