SCHEMBL909904

SCHEMBL909904

O=c1cc(N2CCOCC2)[nH]c2c(-c3ccccc3F)cccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 7/20 0.71
PIK3CA P42336 13/20 0.61
PIK3CD O00329 3/20 0.57
PIK3CB P42338 3/20 0.57
APAF1 O14727 1/20 0.50
CDC25B P30305 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
PRKDC P78527 2/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
PDE2A O00408 1/20 0.45
PIK3C2A O00443 1/20 0.45
PIK3R2 O00459 1/20 0.45
PIK3C2B O00750 1/20 0.45
BRD4 O60885 1/20 0.45
PDE5A O76074 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL4809435 0.85 PIK3CA (0.67) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL4807667 0.83 PIK3CG (1.00) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL4809385 0.82 PRKDC (0.64) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL4105698 0.81 PIK3CA (0.63) PIK3CGPIK3CAPIK3CDPIK3CBPRKDC
SCHEMBL910114 0.79 PIK3CA (0.57) PIK3CGPIK3CAPIK3CDPIK3CBPRKDC
SCHEMBL9284616 0.79 PIK3CG (0.63) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL3549520 0.79 PIK3CG (0.63) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL13437617 0.79 PIK3CG (0.63) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL31061504 0.78 PIK3CG (0.62) PIK3CGPIK3CAPIK3CDPIK3CBAPAF1
SCHEMBL27614335 0.77 PIK3CG (0.61) PIK3CGPIK3CAPIK3CDPIK3CBPRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4646626-B2 2011-03-09 JP claimed
CN-101260104-A Inhibition of phosphoinositide 3-kinase beta ASTRAZENECA AB (SE) 2008-09-10 CN claimed
US-20060276470-A1 (+-)-7-Methyl-2-morpholin-4-yl-9-(1-phenylaminoethyl)-pyrido[1,2-a]pyrimidin-4-one, for example; selective inhibitors of phosphoinositide (PI) 3-kinase beta for use in anti-thrombotic therapy ASTRAZENECA AB (SE) 2006-12-07 US claimed
JP-2006500361-A 2006-01-05 JP claimed
CN-1688575-A INHIBITION OF PHOSPHOINOSITIDE 3-KINASE BETA KINACIA PTY LTD (AU) 2005-10-26 CN claimed
EP-1537102-A1 INHIBITION OF PHSPHOINOSTIDE 3-DINASE BETA Kinacia Pty Ltd. (AU) 2005-06-08 EP claimed
WO-2004016607-A1 INHIBITION OF PHOSPHOINOSITIDE 3-KINASE BETA KINACIA PTY LTD. (AU) 2004-02-26 WO claimed
US-20130102595-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS CURIS, INC. 2013-04-25 US disclosed
EP-2557923-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS Curis, Inc. (US) 2013-02-20 EP disclosed
WO-2011130628-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS CURIS, INC. (US) 2011-10-20 WO disclosed
US-7872011-B2 Inhibition of phosphoinositide 3-kinase β ASTRAZENECA AB (SE) 2011-01-18 US disclosed
US-7598377-B2 (+-)-7-Methyl-2-morpholin-4-yl-9-(1-phenylaminoethyl)-pyrido[1,2-a]pyrimidin-4-one, for example; selective inhibitors of phosphoinositide (PI) 3-kinase beta for use in anti-thrombotic therapy ASTRAZENECA AB (SE) 2009-10-06 US disclosed
US-20080319021-A1 Inhibition Of Phosphoinositide 3-Kinase Beta KINACIA PTY. LTD. (AU) 2008-12-25 US disclosed
CN-100430389-C Inhibition of phosphoinositide 3-kinase beta KINACIA PTY LTD (SE) 2008-11-05 CN disclosed
CN-101260104-A Inhibition of phosphoinositide 3-kinase beta ASTRAZENECA AB (SE) 2008-09-10 CN disclosed
US-20060276470-A1 (+-)-7-Methyl-2-morpholin-4-yl-9-(1-phenylaminoethyl)-pyrido[1,2-a]pyrimidin-4-one, for example; selective inhibitors of phosphoinositide (PI) 3-kinase beta for use in anti-thrombotic therapy ASTRAZENECA AB (SE) 2006-12-07 US disclosed
CN-1688575-A INHIBITION OF PHOSPHOINOSITIDE 3-KINASE BETA KINACIA PTY LTD (AU) 2005-10-26 CN disclosed
EP-1537102-A1 INHIBITION OF PHSPHOINOSTIDE 3-DINASE BETA Kinacia Pty Ltd. (AU) 2005-06-08 EP disclosed
WO-2004016607-A1 INHIBITION OF PHOSPHOINOSITIDE 3-KINASE BETA KINACIA PTY LTD. (AU) 2004-02-26 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-20080319021-A1 Inhibition Of Phosphoinositide 3-Kinase Beta PI4KB, PI4KA, PI4K2B PIK3CG 9/4885PIK3CA 11/4885PIK3CD 8/4885
US-20060276470-A1 (+-)-7-Methyl-2-morpholin-4-yl-9-(1-phenylaminoethyl)-pyrido[1,2-a]pyrimidin-4-one, for example; selective inhibitors of phosphoinositide (PI) 3-kinase beta for use in anti-thrombotic therapy PI4KA, PI4KB, PI4K2B PIK3CG 13/4885PIK3CA 16/4885PIK3CD 15/4885
US-20130102595-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS KRAS, HRAS, KSR2 PIK3CG 198/4885PIK3CA 31/4885PIK3CD 194/4885

“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.