SCHEMBL4041336

SCHEMBL4041336

C[C@H](C[C@H](O)[C@@H](N)Cc1ccccc1)C(=O)Nc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
REN P00797 5/20 0.56
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
LAP3 P28838 3/20 0.49
ANPEP P15144 1/20 0.49
RNPEP Q9H4A4 1/20 0.49
DNPEP Q9ULA0 1/20 0.49
MME P08473 1/20 0.48
ACE P12821 1/20 0.48
LTA4H P09960 1/20 0.46
METAP2 P50579 1/20 0.45
CSNK1E P49674 1/20 0.45
TAAR1 Q96RJ0 1/20 0.44
APP P05067 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL4042459 0.91 REN (0.51) RENMEN1NPC1RAB9AKMT2A
SCHEMBL4047826 0.88 PKM (0.55) RENMEN1NPC1RAB9AKMT2A
SCHEMBL4041807 0.84 REN (0.62) RENKMT2ALAP3ANPEPRNPEP
SCHEMBL4039777 0.83 REN (0.52) RENLAP3ANPEPRNPEPDNPEP
SCHEMBL5619200 0.83 REN (0.53) RENLAP3ANPEPRNPEPDNPEP
SCHEMBL4044758 0.81 REN (0.48) RENMEN1NPC1RAB9AKMT2A
SCHEMBL2845806 0.81 MEN1 (0.79) MEN1NPC1RAB9AKMT2AMME
SCHEMBL4041710 0.81 REN (0.58) RENLAP3ANPEPRNPEPDNPEP
SCHEMBL4040270 0.80 NPSR1 (0.48) RENMEN1NPC1RAB9AKMT2A
SCHEMBL3534806 0.80 REN (0.85) REN

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 REN 717/4885MEN1 2564/4885NPC1 2781/4885

“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.