SCHEMBL939366

SCHEMBL939366

CC(N)c1nc2cccnc2c(=O)n1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 11/20 0.62
PIK3CG P48736 5/20 0.42
PIK3R2 O00459 1/20 0.42
PIK3R1 P27986 4/20 0.41
PDE4A P27815 2/20 0.41
PDE4B Q07343 2/20 0.41
PDE4C Q08493 2/20 0.41
PDE4D Q08499 2/20 0.41
PIK3CB P42338 5/20 0.39
PIK3CA P42336 2/20 0.39
HRH3 Q9Y5N1 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL937948 0.90 PIK3CD (0.59) PIK3CDPIK3CGPIK3R2PIK3R1PDE4A
SCHEMBL10163671 0.82 ALDH1A1 (0.53) HRH3SMN1; SMN2
SCHEMBL10163613 0.82 ALDH1A1 (0.53) HRH3SMN1; SMN2
SCHEMBL11901109 0.81 PDE4B (0.47) PIK3CDPIK3CGPIK3R2PDE4APDE4B
SCHEMBL11900976 0.81 PDE4B (0.47) PIK3CDPIK3CGPIK3R2PDE4APDE4B
SCHEMBL937877 0.78 PIK3CD (0.68) PIK3CDPIK3CGPIK3R2PIK3R1PDE4A
SCHEMBL12912410 0.77 PIK3CD (1.00) PIK3CDPIK3R1PDE4APDE4BPDE4C
SCHEMBL3625059 0.76 PIK3CD (0.46) PIK3CDSMN1; SMN2
SCHEMBL15812927 0.76 PIK3CD (0.60) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA
SCHEMBL15812924 0.76 PIK3CD (0.60) PIK3CDPIK3CGPIK3R1PIK3CBPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110021541-A1 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ICOS CORPORATION 2011-01-27 US disclosed
US-20110021541-A1 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ICOS CORPORATION 2011-01-27 US disclosed
US-20110021541-A1 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ICOS CORPORATION 2011-01-27 US disclosed
EP-2220089-A2 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ICOS CORPORATION (US) 2010-08-25 EP disclosed
WO-2009064802-A2 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ELI LILLY & CO. (US) 2009-05-22 WO disclosed
WO-2009064802-A2 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA ELI LILLY & CO. (US) 2009-05-22 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-20110021541-A1 INHIBITORS OF HUMAN PHOSPHATIDYL-INOSITOL 3-KINASE DELTA PIK3CD, PI4KB, PI4KA PIK3CD 1/4885PIK3CG 4/4885PIK3R2 23/4885

“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.