SCHEMBL248197

SCHEMBL248197

Cc1c(-c2ccccn2)nc2c(C#N)cccc2c1Nc1cc(N2CCOCC2)ncc1-c1cncnc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.41
SOS1 Q07889 1/20 0.38
PIK3R2 O00459 4/20 0.37
PIK3CA P42336 8/20 0.37
LRRK2 Q5S007 1/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
PRKCQ Q04759 1/20 0.35
PRKCD Q05655 1/20 0.35
METAP1 P53582 1/20 0.35
PDE4D Q08499 1/20 0.35
SMG1 Q96Q15 1/20 0.34

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
SCHEMBL246713 0.89 PIK3R2 (0.47) PIK3CDPIK3R2PIK3CAPIK3CBPIK3CG
SCHEMBL247908 0.87 PIK3CD (0.42) PIK3CDPIK3R2PIK3CAATMPIK3CB
SCHEMBL248827 0.86 PIK3CD (0.41) PIK3CDPIK3R2PIK3CAPIK3CBPIK3CG
SCHEMBL249196 0.81 PIK3CA (0.40) PIK3CDSOS1PIK3R2PIK3CALRRK2
SCHEMBL2711238 0.81 PIK3CD (0.48) PIK3CDPIK3R2PIK3CAPIK3CBPIK3CG
SCHEMBL13019249 0.80 PIK3CA (0.43) PIK3CDPIK3R2PIK3CAPIK3CBPIK3CG
SCHEMBL248832 0.80 ATR (0.42) PIK3CDPIK3R2PIK3CASMG1
SCHEMBL247947 0.79 PIK3CD (0.65) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL247875 0.77 PIK3CA (0.49) PIK3CDPIK3CAPIK3CBPIK3CGPDE4D
SCHEMBL248526 0.76 PIK3CD (0.59) PIK3CDPIK3CALRRK2PIK3CBPIK3CG

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
EP-2588471-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY Amgen Inc. (US) 2013-05-08 EP disclosed
US-20130090323-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-11 US disclosed
US-20130090323-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-11 US disclosed
US-20130090323-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-11 US disclosed
WO-2012003283-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 WO disclosed
WO-2012003283-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY AMGEN INC. (US) 2012-01-05 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-20130090323-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 PIK3CD 24/4885SOS1 1106/4885PIK3R2 88/4885

“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.