SCHEMBL7552157

SCHEMBL7552157

CCC1=NC(NC(=O)Nc2cccc(C)c2)C(=O)Nc2ccccc21

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 18/20 0.75
KCNH2 Q12809 1/20 0.48
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL7552167 1.00 CCKBR (0.75) CCKBRKCNH2KDM4EMAPT
SCHEMBL7544975 0.89 CCKBR (0.72) CCKBRKCNH2KDM4EMAPT
SCHEMBL7544972 0.89 CCKBR (0.72) CCKBRKCNH2KDM4EMAPT
SCHEMBL7550925 0.88 CCKBR (0.69) CCKBRKCNH2KDM4EMAPT
SCHEMBL7550924 0.88 CCKBR (0.69) CCKBRKCNH2KDM4EMAPT
SCHEMBL7550799 0.88 CCKBR (0.78) CCKBRKCNH2KDM4EMAPT
SCHEMBL7550802 0.88 CCKBR (0.78) CCKBRKCNH2KDM4EMAPT
SCHEMBL641958 0.86 CCKBR (1.00) CCKBRKCNH2MAPT
SCHEMBL7547182 0.84 CCKBR (0.72) CCKBRKCNH2KDM4EMAPT
SCHEMBL7547190 0.84 CCKBR (0.72) CCKBRKCNH2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20020002163-A1 1,4-benzodiazepinones and their uses as CCK antagonists CCKAR, CCKBR, GABRA4 CCKBR 2/4885KCNH2 253/4885KDM4E 1350/4885

“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.