SCHEMBL7547986

SCHEMBL7547986

CC(C)CC1=NC(N)C(=O)Nc2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CCKBR P32239 5/20 0.39
▸ GFER P55789 1/20 0.36
▸ CHRM1 P11229 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CCKAR P32238 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ CREBBP Q92793 1/20 0.34

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
SCHEMBL7547991 1.00 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7544795 0.86 MEN1 (0.38) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7601420 0.86 MEN1 (0.38) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7552264 0.84 MEN1 (0.41) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7552256 0.84 MEN1 (0.41) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7544295 0.80 CCKBR (0.43) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7544285 0.80 CCKBR (0.43) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7546890 0.78 CHRM1 (0.40) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7546878 0.78 CHRM1 (0.40) ALDH1A1MEN1KMT2ACCKBRGFER
SCHEMBL7546466 0.76 CCKBR (0.52) ALDH1A1MEN1KMT2ACCKBRGFER

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
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

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 ALDH1A1 1169/4885MEN1 2261/4885KMT2A 1298/4885
US-20020183313-A1 1,4-benzodiazepinones and their uses as CCK antagonists CCKAR, CCKBR, GABRA4 ALDH1A1 1169/4885MEN1 2261/4885KMT2A 1298/4885

“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.

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