SCHEMBL4558000

SCHEMBL4558000

CCOC(=O)CCc1cccc(NC(=O)CN2N=C(c3ccccc3)c3ccccc3N(CC(=O)C3CCCC3)C2=O)c1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 14/20 0.66
CCKAR P32238 8/20 0.66

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
SCHEMBL4557999 0.89 CCKBR (0.82) CCKBRCCKAR
SCHEMBL4494479 0.83 CCKBR (0.50) CCKBRCCKAR
SCHEMBL3913222 0.80 CCKBR (1.00) CCKBRCCKAR
SCHEMBL4500797 0.78 CCKBR (0.82) CCKBRCCKAR
SCHEMBL4505102 0.78 CCKBR (0.63) CCKBRCCKAR
SCHEMBL13868249 0.77 CCKBR (0.74) CCKBRCCKAR
SCHEMBL13868362 0.77 CCKBR (0.91) CCKBRCCKAR
SCHEMBL5449645 0.76 CCKBR (0.84) CCKBRCCKAR
SCHEMBL4505312 0.76 CCKBR (0.52) CCKBRCCKAR
SCHEMBL5812109 0.75 CCKBR (0.47) CCKBRCCKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948624-B1 PROCESS FOR THE PREPARATION OF BENZO[E][1,2,4]TRIAZEPIN-2-ONE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2013-10-23 EP disclosed
US-7582753-B2 Process for the preparation of benzotriazepine derivatives JANSSENPHARMACEUTICA, NV (BE) 2009-09-01 US disclosed
US-20070066819-A1 PROCESS FOR THE PREPARATION OF BENZOTRIAZEPINE DERIVATIVES JANSSEN PHARMACUETICA N.V., (BE) 2007-03-22 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-20070066819-A1 PROCESS FOR THE PREPARATION OF BENZOTRIAZEPINE DERIVATIVES CCKBR, CCKAR, GRPR CCKBR 1/4885CCKAR 2/4885

“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.