SCHEMBL936178

SCHEMBL936178

Nc1nc2ccc(-c3cncc(S(=O)(=O)Nc4ccccc4F)c3)cn2n1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 20/20 0.78
PIK3CD O00329 16/20 0.78
PIK3CA P42336 7/20 0.67
PIK3CB P42338 4/20 0.64
PAK4 O96013 1/20 0.47
JAK1 P23458 1/20 0.47
CSNK1A1 P48729 1/20 0.47
AAK1 Q2M2I8 1/20 0.47
PIP4K2C Q8TBX8 1/20 0.47
CSNK1G1 Q9HCP0 1/20 0.47

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
SCHEMBL937554 0.92 PIK3CG (0.75) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL936442 0.89 PIK3CG (0.68) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL938152 0.88 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL938220 0.86 PIK3CG (0.81) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL936615 0.86 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL938043 0.86 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL936168 0.84 PIK3CG (0.79) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL936914 0.84 PIK3CG (0.75) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL937360 0.84 PIK3CG (0.81) PIK3CGPIK3CDPIK3CAPIK3CBPAK4
SCHEMBL936502 0.83 PIK3CG (0.71) PIK3CGPIK3CDPIK3CAPIK3CBPAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222674-B1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LTD (GB) 2015-11-11 EP claimed
US-8865699-B2 Amino triazoles as PI3K inhibitors CELLZOME LTD. (GB) 2014-10-21 US claimed
US-20110021497-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2011-01-27 US claimed
EP-2222674-A1 AMINO TRIAZOLES AS PI3K INHIBITORS Cellzome Limited (GB) 2010-09-01 EP claimed
WO-2009068482-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2009-06-04 WO claimed
EP-2222674-B1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LTD (GB) 2015-11-11 EP disclosed
EP-2222674-B1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LTD (GB) 2015-11-11 EP disclosed
US-8865699-B2 Amino triazoles as PI3K inhibitors CELLZOME LTD. (GB) 2014-10-21 US disclosed
US-8865699-B2 Amino triazoles as PI3K inhibitors CELLZOME LTD. (GB) 2014-10-21 US disclosed
US-8865699-B2 Amino triazoles as PI3K inhibitors CELLZOME LTD. (GB) 2014-10-21 US disclosed
US-20110021497-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2011-01-27 US disclosed
US-20110021497-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2011-01-27 US disclosed
US-20110021497-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2011-01-27 US disclosed
EP-2222674-A1 AMINO TRIAZOLES AS PI3K INHIBITORS Cellzome Limited (GB) 2010-09-01 EP disclosed
WO-2009068482-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2009-06-04 WO disclosed
WO-2009068482-A1 AMINO TRIAZOLES AS PI3K INHIBITORS CELLZOME LIMITED (GB) 2009-06-04 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-20110021497-A1 AMINO TRIAZOLES AS PI3K INHIBITORS PIK3C3, PIK3R3, PIK3R5 PIK3CG 11/4885PIK3CD 6/4885PIK3CA 9/4885

“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.