SCHEMBL16029189

SCHEMBL16029189

Oc1ccnc(-c2ccc(Br)cc2F)n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 1/20 0.38
▸ FEN1 P39748 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NMUR2 Q9GZQ4 1/20 0.36
▸ DGAT1 O75907 3/20 0.34
▸ KMO O15229 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ FPR2 P25090 1/20 0.33
▸ PLAU P00749 2/20 0.32
▸ PLG P00747 1/20 0.32
▸ PLAT P00750 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ BCL2 P10415 1/20 0.32
▸ MCL1 Q07820 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
SCHEMBL1199245 0.79 ALOX5AP (0.43) ALOX5APFEN1NMUR2DGAT1GAA
SCHEMBL31129057 0.77 ALOX5AP (0.35) ALOX5APFEN1KMT2ANMUR2DGAT1
SCHEMBL3824986 0.72 MAPT (0.42) MEN1KMT2AKMOGAA
SCHEMBL27871315 0.70 RAB9A (0.44) MEN1KMT2AGAAHTT
SCHEMBL14520998 0.70 DGAT1 (0.46) ALOX5APFEN1NMUR2DGAT1BCL2
SCHEMBL31310573 0.70 DGAT1 (0.46) ALOX5APFEN1NMUR2DGAT1BCL2
SCHEMBL27164738 0.69 BCL2 (0.45) ALOX5APFEN1MEN1KMT2ANMUR2
SCHEMBL12302791 0.68 ALOX5AP (0.50) ALOX5APFEN1
SCHEMBL30957357 0.68 ESR1 (0.44) MEN1KMT2A
SCHEMBL28107900 0.68 MAPT (0.41) MEN1KMT2AKMOGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3845540-A1 INTERMEDIATES FOR THE SYNTHESIS OF BENZOXAZEPIN COMPOUNDS F. Hoffmann-La Roche AG (CH) 2021-07-07 — — EP disclosed
EP-3845540-A1 INTERMEDIATES FOR THE SYNTHESIS OF BENZOXAZEPIN COMPOUNDS F. Hoffmann-La Roche AG (CH) 2021-07-07 — — EP disclosed
EP-3404032-A2 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS F. Hoffmann-La Roche AG (CH) 2018-11-21 — — EP disclosed
US-9303043-B2 Process for making benzoxazepin compounds GREENTECH, INC. (US) 2016-04-05 — — US disclosed
US-9303043-B2 Process for making benzoxazepin compounds GREENTECH, INC. (US) 2016-04-05 — — US disclosed
US-9303043-B2 Process for making benzoxazepin compounds GREENTECH, INC. (US) 2016-04-05 — — US disclosed
EP-2970329-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS F. Hoffmann-La Roche AG (CH) 2016-01-20 — — EP disclosed
US-20140275523-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS GENENTECH, INC. (US) 2014-09-18 — — US disclosed
US-20140275523-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS GENENTECH, INC. (US) 2014-09-18 — — US disclosed
US-20140275523-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS GENENTECH, INC. (US) 2014-09-18 — — US disclosed
WO-2014140073-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-09-18 — — WO disclosed
WO-2014140073-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-09-18 — — 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-20140275523-A1 PROCESS FOR MAKING BENZOXAZEPIN COMPOUNDS PIK3C2B, PIP4K2C, PIK3C2A ALOX5AP 2002/4885FEN1 3940/4885MEN1 2325/4885

“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.

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