SCHEMBL9529673

SCHEMBL9529673

CNC1N=C(c2ccccc2)c2ccccc2NC1=O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 16/20 0.64
CCKAR P32238 10/20 0.64
MEN1 O00255 1/20 0.57
ALDH1A1 P00352 1/20 0.57
KMT2A Q03164 1/20 0.57

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
SCHEMBL9529682 1.00 CCKBR (0.64) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL24611857 1.00 CCKBR (0.64) CCKBRCCKARMEN1ALDH1A1KMT2A
Bromide SCHEMBL8611955 0.99 CCKBR (0.62) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL12214181 0.91 CCKBR (0.57) CCKBRCCKAR
SCHEMBL14456273 0.85 CCKBR (0.60) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL15402466 0.84 CCKBR (0.62) CCKBRCCKAR
SCHEMBL10196569 0.84 CCKBR (0.69) CCKBRCCKAR
SCHEMBL641936 0.84 CCKBR (0.59) CCKBRCCKARMEN1ALDH1A1KMT2A
SCHEMBL642974 0.84 CCKBR (0.72) CCKBRCCKAR
SCHEMBL29766969 0.84 CCKBR (0.72) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3324977-B1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2022-07-13 EP disclosed
EP-3582784-B1 PROCESSES FOR THE PREPARATION OF BENZODIAZEPINE DERIVATIVES ENANTA PHARM INC (US) 2022-06-08 EP disclosed
EP-3497096-B1 AN ANTIMICROBIAL COMPOUND THE UNIV OF DURHAM (GB) 2021-11-10 EP disclosed
WO-2019067864-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-04-04 WO disclosed
WO-2018033714-A1 AN ANTIMICROBIAL COMPOUND THE UNIVERSITY OF DURHAM (GB) 2018-02-22 WO disclosed
US-7390801-B2 Cycloalkyl, lactam, lactone and related compounds, pharmaceutical compositions comprising same, and methods for inhibiting β-amyloid peptide release and/or its synthesis by use of such compounds ATHENA NEUROSCIENCES, INC. (US) 2008-06-24 US disclosed
EP-0167919-B1 BENZODIAZEPINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1993-05-05 EP disclosed
US-5004741-A Cholecystokinin(CCK); Treating Disorders Of The Gastrointestinal Tract, Central Nervous System And Of The Appetite Of Animals MERCK & CO., INC. (US) 1991-04-02 US disclosed
US-4820834-A Benzodiazepine analogs MERCK & CO., INC. (US) 1989-04-11 US disclosed
EP-0284256-A1 Benzodiazepine analogs MERCK & CO. INC. (US) 1988-09-28 EP disclosed
EP-0167919-A2 Benzodiazepine derivatives and pharmaceutical compositions containing them MERCK & CO. INC. (US) 1986-01-15 EP disclosed