SCHEMBL247135

SCHEMBL247135

Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Nc3cc(Cl)cc(N4CCOCC4)n3)c2C)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 15/20 0.50
PIK3CD O00329 2/20 0.50
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
PIK3R2 O00459 1/20 0.36
SYK P43405 1/20 0.36
LRRK2 Q5S007 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
SCHEMBL246948 0.89 PIK3CD (0.49) PIK3CAPIK3CDPIK3R2LRRK2
SCHEMBL246138 0.88 PIK3CD (0.53) PIK3CAPIK3CDLRRK2
SCHEMBL243776 0.88 PIK3CA (0.52) PIK3CAPIK3CDSYK
SCHEMBL249148 0.81 PIK3CD (0.55) PIK3CAPIK3CD
SCHEMBL248279 0.80 PIK3CD (0.63) PIK3CAPIK3CD
SCHEMBL247436 0.80 PIK3CA (0.44) PIK3CAPIK3CDPIK3R2LRRK2
SCHEMBL2711467 0.79 PIK3CA (0.58) PIK3CAPIK3CD
SCHEMBL2712531 0.79 PIK3CD (0.65) PIK3CAPIK3CD
SCHEMBL248824 0.78 PIK3CD (0.45) PIK3CAPIK3CD
SCHEMBL2713509 0.77 PIK3CD (0.63) PIK3CAPIK3CD

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 PIK3CA 28/4885PIK3CD 24/4885AURKA 934/4885

“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.