SCHEMBL1621241

SCHEMBL1621241

COc1cc(Cl)ncc1-c1ccc2nc(NC(C)=O)sc2c1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 9/20 0.65
PIK3CA P42336 7/20 0.64
ABL1 P00519 3/20 0.57
CYP3A4 P08684 2/20 0.57
DYRK1A Q13627 2/20 0.57
NPC1 O15118 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C19 P33261 1/20 0.57
HTT P42858 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
FSCN1 Q16658 1/20 0.56
SMO Q99835 1/20 0.54

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
SCHEMBL1621834 0.83 ABL1 (0.74) PIK3CGPIK3CAABL1CYP3A4DYRK1A
SCHEMBL1621112 0.82 PIK3CG (0.79) PIK3CGPIK3CACYP3A4SMO
SCHEMBL1620345 0.81 PIK3CA (0.74) PIK3CGPIK3CACYP3A4DYRK1AFSCN1
SCHEMBL1622012 0.80 PIK3CG (0.77) PIK3CGPIK3CAABL1CYP3A4DYRK1A
SCHEMBL1621634 0.79 PIK3CG (0.67) PIK3CGPIK3CAABL1CYP3A4DYRK1A
SCHEMBL13188180 0.78 PIK3CG (0.72) PIK3CGPIK3CACYP3A4DYRK1ANPC1
SCHEMBL3141105 0.78 PIK3CG (1.00) PIK3CGPIK3CACYP3A4DYRK1ANPC1
SCHEMBL1621844 0.78 PIK3CG (0.79) PIK3CGPIK3CACYP3A4DYRK1ANPC1
SCHEMBL1621705 0.77 PIK3CG (1.00) PIK3CGPIK3CACYP3A4DYRK1ANPC1
SCHEMBL1621640 0.77 PIK3CG (0.74) PIK3CGPIK3CACYP3A4DYRK1ANPC1

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
EP-2183232-B1 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2013-03-06 EP claimed
EP-2183232-A2 PI3 KINASE MODULATORS AND METHODS OF USE Amgen, Inc (US) 2010-05-12 EP claimed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US claimed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 WO claimed
EP-2183232-B1 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2013-03-06 EP disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
US-7928140-B2 Benzothiazole PI3 kinase modulators for cancer treatment AMGEN INC. (US) 2011-04-19 US disclosed
EP-2183232-A2 PI3 KINASE MODULATORS AND METHODS OF USE Amgen, Inc (US) 2010-05-12 EP disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
US-20090054405-A1 PI3 kinase modulators and methods of use AMGEN INC. (US) 2009-02-26 US disclosed
WO-2009017822-A2 PI3 KINASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2009-02-05 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 (1 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-20090054405-A1 PI3 kinase modulators and methods of use PIK3CA, PIK3C2A, PIK3C2B PIK3CG 5/4885PIK3CA 1/4885ABL1 561/4885

“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.