SCHEMBL249624

SCHEMBL249624

CC(Nc1ncnc2[nH]cnc12)c1cc2ccc(F)cc2nc1CCC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 17/20 0.46
PIK3CG P48736 4/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
MAP4K4 O95819 1/20 0.34
PIK3C3 Q8NEB9 1/20 0.33
EGFR P00533 1/20 0.32

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
SCHEMBL3414335 1.00 PIK3CD (0.46) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL246482 0.91 PIK3CD (0.49) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL249839 0.91 PIK3CD (0.49) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL249676 0.89 PIK3CD (0.47) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL3414056 0.89 PIK3CD (0.47) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL249592 0.89 PIK3CD (0.46) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL3415150 0.89 PIK3CD (0.46) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL3426444 0.88 PIK3CD (0.49) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL250360 0.88 PIK3CD (0.49) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4
SCHEMBL3422319 0.88 PIK3CD (0.45) PIK3CDPIK3CGPIK3CAPIK3CBMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2588469-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE AS INHIBITORS OF PI3K ACTIVITY Amgen Inc. (US) 2013-05-08 EP disclosed
US-20130096134-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2013-04-18 US disclosed
WO-2012003271-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-20130096134-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, SSB, MALT1 PIK3CD 1662/4885PIK3CG 2443/4885PIK3CA 1420/4885

“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.