SCHEMBL9893469

SCHEMBL9893469

CCN1C(=O)C(C)(C)C(=O)N(C)c2cccc(OCc3ccccc3)c21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.43
HTT P42858 1/20 0.41
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KCNA5 P22460 3/20 0.40
KCNJ5 P48544 3/20 0.40
KCNJ3 P48549 3/20 0.40
ALDH1A1 P00352 3/20 0.39
BRD4 O60885 2/20 0.39
HPGD P15428 1/20 0.39
HTR6 P50406 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GAA P10253 1/20 0.37
HTR1A P08908 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36

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
SCHEMBL9893537 0.77 BRD4 (0.45) HTTMAPTMAPK1TDP1L3MBTL1
SCHEMBL9893431 0.77 KCNA5 (0.58) KCNA5KCNJ5KCNJ3
SCHEMBL9893505 0.75 GPR55 (0.38) ELANEMAPTMAPK1L3MBTL1KCNA5
Hydrochloric Acid SCHEMBL9960363 0.72 ELANE (0.46) ELANEHTTMAPTKCNA5KCNJ5
SCHEMBL9893372 0.71 KCNA5 (0.50) ELANEKCNA5KCNJ5KCNJ3
SCHEMBL9893251 0.70 KCNA5 (0.51) KCNA5KCNJ5KCNJ3
SCHEMBL11149823 0.69 MAPT (0.47) MAPTMAPK1TDP1L3MBTL1ALDH1A1
SCHEMBL9750259 0.68 MAPT (0.46) MAPTMAPK1TDP1L3MBTL1ALDH1A1
SCHEMBL9893492 0.67 KCNA5 (0.47) ELANEKCNA5KCNJ5KCNJ3
SCHEMBL9591238 0.67 LMNA (0.50) ELANEHTTMAPTL3MBTL1ALDH1A1

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-8940889-B2 Process for producing benzo [b] [1,4] diazepine-2,4-dione compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-01-27 US disclosed
US-8796447-B2 Process for producing benzo[B][1,4]diazepine-2,4-dione compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-08-05 US disclosed
US-20140194621-A1 PROCESS FOR PRODUCING BENZO [B] [1,4] DIAZEPINE-2, 4-DIONE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-07-10 US disclosed
EP-2468733-A1 PROCESS FOR PRODUCING BENZO[B][1,4]DIAZEPINE-2,4-DIONE COMPOUND Otsuka Pharmaceutical Co., Ltd. (JP) 2012-06-27 EP disclosed
US-20120149899-A1 PROCESS FOR PRODUCING BENZO[B][1,4]DIAZEPINE-2,4-DIONE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-06-14 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-20120149899-A1 PROCESS FOR PRODUCING BENZO[B][1,4]DIAZEPINE-2,4-DIONE COMPOUND KCNH1, KCNB2, KCNJ2 ELANE 4701/4885HTT 1478/4885MAPT 4600/4885
US-20140194621-A1 PROCESS FOR PRODUCING BENZO [B] [1,4] DIAZEPINE-2, 4-DIONE COMPOUND KCNH1, KCNB2, KCNB1 ELANE 4753/4885HTT 1075/4885MAPT 4472/4885

“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.