SCHEMBL15490518

SCHEMBL15490518

C=C(O)c1cn2c(n1)-c1ccc(Br)cc1OCC2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 14/20 0.40
PIK3CD O00329 4/20 0.39
PIK3R1 P27986 1/20 0.39
PIK3CA P42336 6/20 0.39
PIK3CG P48736 3/20 0.39
PIK3CB P42338 2/20 0.39

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
SCHEMBL1485015 0.88 MAP3K14 (0.44) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG
SCHEMBL1484994 0.84 MAP3K14 (0.55) MAP3K14PIK3CDPIK3R1
SCHEMBL16074591 0.82 PIK3CA (0.42) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG
SCHEMBL17613233 0.82 MAP3K14 (0.42) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG
SCHEMBL1484978 0.81 MAP3K14 (0.43) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG
SCHEMBL19594359 0.81 PIK3CA (0.43) PIK3CDPIK3CAPIK3CGPIK3CB
SCHEMBL18655441 0.80 MAP3K14 (0.41) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG
SCHEMBL1485127 0.80 PIK3CA (0.42) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG
SCHEMBL1485055 0.80 PIK3CA (0.42) PIK3CDPIK3CAPIK3CGPIK3CB
SCHEMBL12696762 0.79 PIK3CA (0.41) MAP3K14PIK3CDPIK3R1PIK3CAPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785626-B2 Benzoxazepin PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2014-07-22 US disclosed
US-20140058098-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2014-02-27 US 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-20140058098-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE BMX, PIK3CA, PI4KA MAP3K14 210/4885PIK3CD 7/4885PIK3R1 15/4885

“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.