SCHEMBL370181

SCHEMBL370181

Fc1cc(-c2cc(NCCc3cccnc3)nc(N3CCOCC3)n2)c2cc[nH]c2c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 12/20 0.66
PIK3CB P42338 3/20 0.62
PIK3CG P48736 3/20 0.62
ACHE P22303 1/20 0.43
ATR Q13535 3/20 0.43
RAD52 P43351 1/20 0.42
CSNK1D P48730 1/20 0.40

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
SCHEMBL13241456 0.91 PIK3CA (0.66) PIK3CAPIK3CBPIK3CGACHERAD52
SCHEMBL13220255 0.90 PIK3CA (0.79) PIK3CAPIK3CBPIK3CGACHEATR
SCHEMBL3040376 0.88 PIK3CA (0.64) PIK3CAPIK3CBPIK3CGACHEATR
SCHEMBL3037741 0.87 PIK3CA (0.62) PIK3CAPIK3CBPIK3CGACHEATR
SCHEMBL3040686 0.87 PIK3CA (0.62) PIK3CAPIK3CBPIK3CGACHEATR
SCHEMBL3029737 0.86 PIK3CA (0.62) PIK3CAPIK3CBPIK3CGACHERAD52
SCHEMBL1029257 0.86 PIK3CA (0.56) PIK3CAPIK3CBPIK3CGATR
SCHEMBL1028146 0.86 PIK3CA (0.71) PIK3CAPIK3CBPIK3CGATRRAD52
SCHEMBL1308679 0.86 PIK3CA (0.56) PIK3CAPIK3CBPIK3CGATRRAD52
SCHEMBL3037754 0.85 PIK3CA (0.60) PIK3CAPIK3CBPIK3CGACHERAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US claimed
WO-2012009452-A1 THE ROLE OF P13K P110 DELTA SIGNALING IN RETROVIRAL INFECTION AND REPLICATION PHILADELPHIA HEALTH & EDUCATION CORPORATION (US) 2012-01-19 WO claimed
US-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-08-19 US claimed
EP-2152693-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2010-02-17 EP claimed
WO-2008125835-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS PIRAMED LIMITED (GB) 2008-10-23 WO claimed
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US disclosed
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-05-09 US disclosed
US-20120184519-A1 Compositions and Methods for Preventing or Treating Influenza Virus Infection THE BABRAHAM INSTITUTE 2012-07-19 US disclosed
US-20110135655-A1 Role of PI3K p110 delta Signaling in Retroviral Infection and Replication PHILADELPHIA HEALTH AND EDUCATION CORPORATION d/b/a Drexel University College of Medicine; 2011-06-09 US disclosed
US-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-08-19 US disclosed
US-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-08-19 US disclosed
US-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-08-19 US disclosed
EP-2152693-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2010-02-17 EP disclosed
WO-2008125835-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS PIRAMED LIMITED (GB) 2008-10-23 WO disclosed
WO-2008125835-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS PIRAMED LIMITED (GB) 2008-10-23 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 (4 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-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885PIK3CB 3/4885PIK3CG 5/4885
US-20110135655-A1 Role of PI3K p110 delta Signaling in Retroviral Infection and Replication PIK3R5, PIK3R4, PIK3R1 PIK3CA 10/4885PIK3CB 11/4885PIK3CG 8/4885
US-20120184519-A1 Compositions and Methods for Preventing or Treating Influenza Virus Infection PIK3R5, PIK3C2A, PIK3C2B PIK3CA 9/4885PIK3CB 10/4885PIK3CG 5/4885
US-20130116267-A1 Role of PI3K P110 Delta Signaling in Retroviral Infection and Replication PIK3R5, PIK3R4, PIK3R3 PIK3CA 10/4885PIK3CB 11/4885PIK3CG 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.