SCHEMBL1621640

SCHEMBL1621640

COc1ccc(-c2ccc3nc(NC(C)=O)sc3c2)cc1F

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 12/20 0.74
PIK3CA P42336 7/20 0.67
DYRK1A Q13627 4/20 0.62
CYP3A4 P08684 2/20 0.62
NPC1 O15118 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C19 P33261 1/20 0.62
HTT P42858 1/20 0.62
RAB9A P51151 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
PDPK1 O15530 1/20 0.62
PIK3CB P42338 1/20 0.58
PI4KB Q9UBF8 1/20 0.58

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
SCHEMBL13188180 0.85 PIK3CG (0.72) PIK3CGPIK3CADYRK1ACYP3A4NPC1
SCHEMBL3712303 0.84 PIK3CG (0.69) PIK3CGPIK3CADYRK1ACYP3A4NPC1
SCHEMBL1621218 0.81 PIK3CG (0.51) PIK3CGPIK3CADYRK1ACYP3A4NPC1
SCHEMBL1621844 0.80 PIK3CG (0.79) PIK3CGPIK3CADYRK1ACYP3A4NPC1
SCHEMBL3141105 0.80 PIK3CG (1.00) PIK3CGPIK3CADYRK1ACYP3A4NPC1
SCHEMBL1621112 0.80 PIK3CG (0.79) PIK3CGPIK3CACYP3A4
SCHEMBL3873624 0.80 PIK3CG (0.76) PIK3CGPIK3CADYRK1ACYP3A4NPC1
SCHEMBL3136731 0.80 PIK3CA (0.78) PIK3CGPIK3CADYRK1ACYP3A4PDPK1
SCHEMBL1621000 0.80 PIK3CG (0.69) PIK3CGPIK3CACYP3A4PIK3CB
SCHEMBL1621705 0.79 PIK3CG (1.00) PIK3CGPIK3CADYRK1ACYP3A4NPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 1/4885DYRK1A 841/4885

“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.