SCHEMBL247333

SCHEMBL247333

COc1ccc(-c2cnc(N3CCOCC3)cc2Nc2c(C)c(-c3cc(C)ccn3)nc3cc(F)cc(F)c23)cc1F

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.52
PIK3CA P42336 8/20 0.46
ZAP70 P43403 1/20 0.38
RAF1 P04049 2/20 0.38
BRAF P15056 2/20 0.38
KIT P10721 2/20 0.37
JUN P05412 1/20 0.36
MAPK8 P45983 1/20 0.36
MAPK10 P53779 1/20 0.36
TNIK Q9UKE5 1/20 0.36
LRRK2 Q5S007 2/20 0.36
ATR Q13535 1/20 0.35
ATRIP Q8WXE1 1/20 0.35
MAP4K1 Q92918 2/20 0.35
CSF1R P07333 1/20 0.35

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
SCHEMBL248298 0.93 PIK3CD (0.51) PIK3CDPIK3CARAF1BRAFLRRK2
SCHEMBL248184 0.92 PIK3CD (0.62) PIK3CDPIK3CAKITJUNMAPK8
SCHEMBL248643 0.92 PIK3CD (0.52) PIK3CDPIK3CAZAP70RAF1BRAF
SCHEMBL248533 0.90 PIK3CD (0.54) PIK3CDPIK3CAZAP70RAF1BRAF
SCHEMBL246471 0.86 PIK3CD (0.49) PIK3CDPIK3CARAF1BRAFLRRK2
SCHEMBL249157 0.85 PIK3CD (0.60) PIK3CDPIK3CAATRATRIP
SCHEMBL248508 0.85 PIK3CD (0.60) PIK3CDPIK3CA
SCHEMBL252021 0.84 PIK3CD (0.68) PIK3CDPIK3CA
SCHEMBL249148 0.84 PIK3CD (0.55) PIK3CDPIK3CA
SCHEMBL249044 0.83 PIK3CD (0.58) PIK3CDPIK3CA

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 24/4885PIK3CA 28/4885ZAP70 67/4885

“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.