SCHEMBL4413880

SCHEMBL4413880

CC(C)(C)c1ccc(COc2ccn3c(=O)cc(N4CCOCC4)nc3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.52
PIK3CD O00329 13/20 0.48
PIK3CB P42338 13/20 0.48
PIK3CA P42336 10/20 0.48
MTOR P42345 1/20 0.42
PIK3CG P48736 2/20 0.42
POLB P06746 2/20 0.41
GAA P10253 1/20 0.41
NPC1 O15118 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CASP3 P42574 1/20 0.41

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
SCHEMBL4414014 0.87 PRKDC (0.53) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4413883 0.87 PRKDC (0.61) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4805433 0.86 PRKDC (0.54) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4422989 0.82 PIK3CB (0.58) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4413947 0.81 PRKDC (0.55) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4417237 0.81 PIK3CB (0.60) PRKDCPIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL13989472 0.80 PIK3CB (0.56) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4415588 0.79 PRKDC (0.58) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4551643 0.78 PIK3CB (0.61) PRKDCPIK3CDPIK3CBPIK3CAMTOR
SCHEMBL4413873 0.75 PRKDC (0.37) PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572791-B2 Therapeutic morpholino-substituted compounds ASTRAZENECA AB (SE) 2009-08-11 US disclosed
US-20080312233-A1 Therapeutic Morpholino-Substituted Compounds KINACIA PTY. LTD. (AU) 2008-12-18 US disclosed
US-20080206312-A1 Therapeutic Morpholino-Substituted Compounds KINACIA PTY. LTD. (AU) 2008-08-28 US disclosed
US-7405211-B2 Using 2-morpholinyl-4H-pyrido(1,2-a)pyrimidin-4-one; enzyme inhibitors; antithrombotic agents ; restenosis; atherosclerosis; antihistamines; chronic obsessive pulminary disease; autoimmune diseases; anticancer agents; antiinflammatory agents ASTRAZENECA AB (SE) 2008-07-29 US disclosed
EP-1857443-A2 Therapeutic morpholino-substituted compounds AstraZeneca AB (SE) 2007-11-21 EP disclosed
EP-1257537-B1 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS ASTRAZENECA AB (SE) 2007-05-30 EP disclosed
US-6977255-B2 Therapeutic morpholino-substituted compounds KINACIA PTY. LTD. (AU) 2005-12-20 US disclosed
US-20050085471-A1 Therapeutic morpholino-substituted compounds KINACIA PTY LTD. 2005-04-21 US disclosed
EP-1257537-A4 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS KINACIA PTY LTD (AU) 2003-04-23 EP disclosed
EP-1257537-A1 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS Kinacia Pty Ltd (AU) 2002-11-20 EP disclosed
WO-2001053266-A1 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS KINACIA PTY LTD. (AU) 2001-07-26 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 (3 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-20050085471-A1 Therapeutic morpholino-substituted compounds PIK3CA, PTK2, PDPK1 PRKDC 1024/4885PIK3CD 13/4885PIK3CB 14/4885
US-20080206312-A1 Therapeutic Morpholino-Substituted Compounds PIK3CA, PTK2, PDPK1 PRKDC 1026/4885PIK3CD 13/4885PIK3CB 14/4885
US-20080312233-A1 Therapeutic Morpholino-Substituted Compounds PIK3CA, PTK2, PDPK1 PRKDC 1026/4885PIK3CD 13/4885PIK3CB 14/4885

“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.