SCHEMBL4415588

SCHEMBL4415588

O=c1cc(N2CCOCC2)nc2cc(OCc3ccccn3)ccn12

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 7/20 0.58
PIK3CA P42336 9/20 0.55
PIK3CD O00329 5/20 0.55
PIK3CB P42338 5/20 0.55
P2RY12 Q9H244 1/20 0.53
FFAR1 O14842 1/20 0.52
MTOR P42345 1/20 0.49
TYK2 P29597 1/20 0.46
SYK P43405 1/20 0.46
BRSK1 Q8TDC3 1/20 0.46
IRAK4 Q9NWZ3 1/20 0.46

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
SCHEMBL4413883 0.88 PRKDC (0.61) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4805433 0.84 PRKDC (0.54) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4551643 0.84 PIK3CB (0.61) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4413947 0.83 PRKDC (0.55) PRKDCPIK3CAPIK3CDPIK3CBP2RY12
SCHEMBL4414014 0.82 PRKDC (0.53) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4417237 0.81 PIK3CB (0.60) PRKDCPIK3CAPIK3CDPIK3CB
SCHEMBL13752221 0.81 PIK3CA (0.64) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4413932 0.81 PRKDC (0.66) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4422989 0.81 PIK3CB (0.58) PRKDCPIK3CAPIK3CDPIK3CBMTOR
SCHEMBL4413880 0.79 PRKDC (0.52) PRKDCPIK3CAPIK3CDPIK3CBMTOR

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 8 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

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 1024/4885PIK3CA 1/4885PIK3CD 13/4885
US-20080206312-A1 Therapeutic Morpholino-Substituted Compounds PIK3CA, PTK2, PDPK1 PRKDC 1026/4885PIK3CA 1/4885PIK3CD 13/4885
US-20080312233-A1 Therapeutic Morpholino-Substituted Compounds PIK3CA, PTK2, PDPK1 PRKDC 1026/4885PIK3CA 1/4885PIK3CD 13/4885

“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.