SCHEMBL4041089

SCHEMBL4041089

NC(=O)c1c(Br)cccc1CNC[C@H](O)[CH]Cc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
BCHE P06276 2/20 0.34
ANPEP P15144 1/20 0.33
MAPK8 P45983 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AURKA O14965 1/20 0.32
RPS6KB1 P23443 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL4044405 0.87 KDM4E (0.37) SMN1; SMN2KDM4E
SCHEMBL4043224 0.87 BCHE (0.35) BCHEANPEPMAPK8
SCHEMBL4038669 0.86 CD274 (0.38) KMT2A
SCHEMBL5720767 0.84 TXNRD1 (0.39) BCHEGAAAURKARPS6KB1KDM4E
SCHEMBL4041577 0.84 ALDH1A1 (0.38) MEN1KMT2ABCHEMAPK8GAA
SCHEMBL4047555 0.80 SIRT1 (0.38) GAASMN1; SMN2AURKARPS6KB1KDM4E
SCHEMBL4040092 0.78 RPS6KB1 (0.37) KMT2ABCHEANPEPRPS6KB1KDM4E
SCHEMBL4045031 0.77 KDM1A (0.46) MEN1KMT2ABCHE
SCHEMBL5219600 0.75 ANPEP (0.46) MEN1KMT2ABCHEANPEP
SCHEMBL4043818 0.75 BCHE (0.41) BCHEANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612054-B2 Dibenzo[b,f]oxepine-10-carboxamides and pharmaceutical uses thereof NOVARTIS AG (CH) 2009-11-03 US disclosed
EP-1651592-B1 NOVEL DIBENZO[B,F]OXEPINE-10-CARBOXAMIDES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2009-04-29 EP disclosed
US-20070111991-A1 Novel dibenzo [b, f] oxepine-10-carboxamides and pharmaceutical uses thereof NOVARTIS AG (CH) 2007-05-17 US disclosed
EP-1651592-A2 NOVEL DIBENZO[B,F]OXEPINE-10-CARBOXAMIDES AND PHARMACEUTICAL USES THEREOF Novartis AG (CH) 2006-05-03 EP disclosed
WO-2005014517-A2 NOVEL DIBENZO[B,F]OXEPINE-10-CARBOXAMIDES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2005-02-17 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-20070111991-A1 Novel dibenzo [b, f] oxepine-10-carboxamides and pharmaceutical uses thereof APP, BACE1, BCHE MEN1 2564/4885KMT2A 3287/4885BCHE 3/4885

“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.