SCHEMBL14726709

SCHEMBL14726709

C[C@H](Nc1nc(N)ncc1-c1cncs1)c1cc2cccc(-c3cnc(O)nc3)c2c(=O)n1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 19/20 0.46
PIK3CD O00329 17/20 0.43
PIK3CA P42336 4/20 0.43
PIK3CB P42338 3/20 0.43
PIK3R1 P27986 8/20 0.41
PIK3R2 O00459 4/20 0.41
ABCB11 O95342 1/20 0.41
TBXA2R P21731 1/20 0.41
HTR2A P28223 1/20 0.41
PDE3A Q14432 1/20 0.41

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
SCHEMBL14727052 0.91 PIK3CG (0.45) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14726712 0.89 PIK3CG (0.47) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14726675 0.87 PIK3CD (0.54) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14727097 0.82 PIK3CG (0.45) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14729735 0.81 PIK3CD (0.56) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14727101 0.80 PIK3CG (0.48) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14729890 0.79 PIK3CD (0.56) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14726498 0.79 PIK3CG (0.46) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL14726783 0.79 PIK3CD (0.55) PIK3CGPIK3CDPIK3CAPIK3CBPIK3R1
SCHEMBL17235431 0.78 PIK3CD (0.52) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130053362-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLKINE, LLC (US) 2013-02-28 US disclosed
US-20130053362-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLKINE, LLC (US) 2013-02-28 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 (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-20130053362-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF AKT3, PIK3CA, AKT1 PIK3CG 14/4885PIK3CD 5/4885PIK3CA 2/4885

“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.