SCHEMBL4036975

SCHEMBL4036975

N[C@@H](Cc1ccccc1)[C@@H](O)CNCCCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 13/20 0.53
CSNK1E P49674 1/20 0.48

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
SCHEMBL3356781 1.00 SIGMAR1 (0.53) SIGMAR1CSNK1E
SCHEMBL6892570 1.00 SIGMAR1 (0.53) SIGMAR1CSNK1E
SCHEMBL3356645 0.95 SIGMAR1 (0.53) SIGMAR1CSNK1E
SCHEMBL6887457 0.95 SIGMAR1 (0.53) SIGMAR1CSNK1E
SCHEMBL4049171 0.95 SIGMAR1 (0.53) SIGMAR1CSNK1E
SCHEMBL14627960 0.94 CSNK1E (0.53) CSNK1E
SCHEMBL496056 0.89 ANPEP (0.55) SIGMAR1CSNK1E
SCHEMBL3347864 0.89 ANPEP (0.55) SIGMAR1CSNK1E
SCHEMBL4044665 0.89 ANPEP (0.55) SIGMAR1CSNK1E
SCHEMBL4696783 0.89 ANPEP (0.55) SIGMAR1CSNK1E

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 SIGMAR1 444/4885CSNK1E 873/4885

“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.