SCHEMBL7552297

SCHEMBL7552297

NC1N=C(c2ccccc2F)c2cccc(Cl)c2NC1=O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 9/20 0.46
CCKAR P32238 3/20 0.41
NOTCH1 P46531 1/20 0.41
NOTCH3 Q9UM47 1/20 0.41
NSD2 O96028 1/20 0.40
BCHE P06276 1/20 0.40
DAO P14920 1/20 0.40
CES1 P23141 1/20 0.40
LMNA P02545 1/20 0.39
PGR P06401 1/20 0.39

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
SCHEMBL7552301 1.00 CCKBR (0.46) CCKBRCCKARNOTCH1NOTCH3NSD2
SCHEMBL18324100 0.85 NOTCH1 (0.52) NOTCH1NOTCH3NSD2BCHEDAO
SCHEMBL15608321 0.85 NOTCH1 (0.52) NOTCH1NOTCH3NSD2BCHEDAO
SCHEMBL15629464 0.85 NOTCH1 (0.52) NOTCH1NOTCH3NSD2BCHEDAO
SCHEMBL7544945 0.85 CCKBR (0.41) CCKBRCCKARNOTCH1NOTCH3DAO
SCHEMBL7544940 0.85 CCKBR (0.41) CCKBRCCKARNOTCH1NOTCH3DAO
SCHEMBL15623736 0.84 NOTCH1 (0.46) CCKBRCCKARNOTCH1NOTCH3NSD2
SCHEMBL15628179 0.84 NOTCH1 (0.46) CCKBRCCKARNOTCH1NOTCH3NSD2
SCHEMBL7543703 0.82 CCKBR (0.43) CCKBRCCKAR
SCHEMBL7543698 0.82 CCKBR (0.43) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020183313-A1 1,4-benzodiazepinones and their uses as CCK antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-05 US disclosed
US-20020002163-A1 1,4-benzodiazepinones and their uses as CCK antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 US disclosed
US-6291452-B1 CHOLECYSTOKININ ANTAGONISTS. FUJISAWA PHARMACETICAL CO., LTD. (JP) 2001-09-18 US disclosed
EP-0934282-A1 1,4-BENZODIAZEPINONES AND THEIR USES AS CCK ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-08-11 EP disclosed
WO-1998015535-A1 1,4-BENZODIAZEPINONES AND THEIR USES AS CCK ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-04-16 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 (2 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-20020002163-A1 1,4-benzodiazepinones and their uses as CCK antagonists CCKAR, CCKBR, GABRA4 CCKBR 2/4885CCKAR 1/4885NOTCH1 3631/4885
US-20020183313-A1 1,4-benzodiazepinones and their uses as CCK antagonists CCKAR, CCKBR, GABRA4 CCKBR 2/4885CCKAR 1/4885NOTCH1 3631/4885

“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.