SCHEMBL799298

SCHEMBL799298

CCNC(=O)c1ccncc1NC(=O)Nc1nc2c(s1)CN(c1cnc(OC)c(OC)c1)CC2

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 13/20 0.64
PIK3CD O00329 2/20 0.54
JAK2 O60674 1/20 0.49
NTRK1 P04629 1/20 0.43
PRKDC P78527 1/20 0.43
GCK P35557 2/20 0.40
PIK3CA P42336 1/20 0.40
HCAR1 Q9BXC0 1/20 0.40
ALOX15 P16050 1/20 0.39

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
SCHEMBL10085347 0.87 PIK3CG (0.78) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL10085353 0.83 PIK3CG (0.82) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL798671 0.83 PIK3CG (0.54) PIK3CGPIK3CDNTRK1PRKDCGCK
SCHEMBL172096 0.82 PIK3CG (0.66) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL10085423 0.82 PIK3CG (0.76) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL798931 0.82 PIK3CG (0.53) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL799299 0.81 PIK3CG (0.62) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL10085344 0.80 PIK3CG (0.75) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL799136 0.80 PIK3CG (0.64) PIK3CGPIK3CDJAK2NTRK1PRKDC
SCHEMBL10085343 0.79 PIK3CG (1.00) PIK3CGPIK3CDJAK2PIK3CAALOX15

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-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-03-22 US disclosed
US-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-03-22 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-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY MTOR, STAT3, SLC14A1 PIK3CG 16/4885PIK3CD 10/4885JAK2 57/4885

“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.