SCHEMBL799081

SCHEMBL799081

CC(C)NC(=O)c1ccccc1NC(=O)Nc1nc2c(s1)CN(c1cncc(C(F)(F)F)c1)CC2

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 13/20 0.51
P2RY1 P47900 3/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
JAK2 O60674 1/20 0.40
GCK P35557 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
SCHEMBL799088 0.91 PIK3CG (0.48) PIK3CGP2RY1JAK2
SCHEMBL799158 0.90 PIK3CG (0.44) PIK3CGP2RY1LMNAMEN1KMT2A
SCHEMBL798644 0.89 PIK3CG (0.66) PIK3CGLMNAMEN1KMT2AJAK2
SCHEMBL799272 0.87 PIK3CG (0.51) PIK3CGLMNAGCK
SCHEMBL799087 0.87 PIK3CG (0.51) PIK3CGLMNAMEN1KMT2AGCK
SCHEMBL799356 0.86 P2RY1 (0.44) PIK3CGP2RY1LMNAMEN1KMT2A
SCHEMBL798939 0.85 PIK3CG (0.50) PIK3CGLMNAMEN1KMT2AJAK2
SCHEMBL798708 0.85 PIK3CG (0.48) PIK3CGP2RY1JAK2GCK
SCHEMBL171977 0.85 PIK3CG (0.49) PIK3CGLMNAMEN1KMT2AGCK
SCHEMBL805099 0.84 PIK3CG (0.47) PIK3CGP2RY1LMNAMEN1KMT2A

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 16/4885P2RY1 3966/4885LMNA 4258/4885

“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.