SCHEMBL12992183

SCHEMBL12992183

CC(=O)Nc1nc(C)c(-c2cccc(N)c2)s1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 15/20 0.60
PIK3CD O00329 13/20 0.60
PIK3CA P42336 12/20 0.60
PIK3CB P42338 11/20 0.60
XIAP P98170 1/20 0.53
CLK1 P49759 1/20 0.51
PIK3C3 Q8NEB9 3/20 0.49
PIK3C2A O00443 1/20 0.49
PIK3C2B O00750 1/20 0.49
PI4KA P42356 1/20 0.49
PRKDC P78527 1/20 0.49
PI4KB Q9UBF8 1/20 0.49
PIK3R1 P27986 1/20 0.48

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
SCHEMBL12991137 0.86 PIK3CG (0.63) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL12991810 0.84 PIK3CG (0.62) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL3596697 0.84 XIAP (0.47) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL49374 0.84 ABL1 (0.50) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL48393 0.83 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL12992093 0.83 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
Hydrochloric Acid SCHEMBL7140582 0.83 XIAP (0.46) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL48567 0.83 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBXIAP
SCHEMBL12991171 0.82 ALDH1A1 (0.61) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL925427 0.82 PIK3CG (0.56) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8344153-B2 Inhibitors of phosphatidylinositol 3-kinase VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-01-01 US disclosed
US-20100316605-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-16 US disclosed
WO-2010144513-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-12-16 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-20100316605-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE PIK3CA, PIK3CG, PIK3CD PIK3CG 2/4885PIK3CD 3/4885PIK3CA 1/4885

“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.