SCHEMBL12700643

SCHEMBL12700643

COCCOCCOCCN(C(=O)OC(C)(C)C)c1cc(CO)cc(CO)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.35
F2 P00734 4/20 0.34
CSNK2A2 P19784 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL12695835 0.90 NR1I2 (0.38) CSNK2A1F2CSNK2A2L3MBTL1
SCHEMBL22508149 0.89 F2 (0.34) CSNK2A1F2CSNK2A2L3MBTL1
SCHEMBL22508201 0.84 F2 (0.36) CSNK2A1F2L3MBTL1
SCHEMBL22508171 0.80 CSNK2A1 (0.39) CSNK2A1F2CSNK2A2L3MBTL1KDM4E
SCHEMBL22508203 0.78 F2 (0.33) F2
SCHEMBL3420582 0.78
SCHEMBL25522772 0.77 F2 (0.41) CSNK2A1F2CSNK2A2L3MBTL1KDM4E
SCHEMBL18539035 0.74 CA2 (0.32)
SCHEMBL12700722 0.72 CA2 (0.31)
SCHEMBL30179199 0.72 DGAT1 (0.34) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020205564-A1 CYTOTOXIC BIS-BENZODIAZEPINE DERIVATIVES AND CONJUGATES THEREOF WITH CELL-BINDING AGENTS FOR INHIBITING ABNORMAL CELL GROWTH OR FOR TREATING PROLIFERATIVE DISEASES IMMUNOGEN, INC. (US) 2020-10-08 WO disclosed
EP-3666289-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES ImmunoGen, Inc. (US) 2020-06-17 EP disclosed
US-10570212-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2020-02-25 US disclosed
EP-3053600-B1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2020-01-29 EP disclosed
US-20190263924-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2019-08-29 US disclosed
US-10179818-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2019-01-15 US disclosed
US-9840564-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2017-12-12 US disclosed
US-20170044266-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2017-02-16 US disclosed
US-9434748-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2016-09-06 US disclosed
EP-3053600-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES ImmunoGen, Inc. (US) 2016-08-10 EP disclosed
US-20160108129-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2016-04-21 US disclosed
EP-2675479-B1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2016-01-13 EP disclosed
US-9169272-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2015-10-27 US disclosed
US-20150099874-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2015-04-09 US disclosed
US-8889669-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2014-11-18 US disclosed
US-8765740-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2014-07-01 US disclosed
US-20140088089-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES AND METHODS OF PREPARATION IMMUNOGEN, INC. (US) 2014-03-27 US disclosed
US-20130302359-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2013-11-14 US disclosed
WO-2012128868-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2012-09-27 WO disclosed
US-20120244171-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2012-09-27 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 (9 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-10179818-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-10570212-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-20150099874-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-20140088089-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES AND METHODS OF PREPARATION GABRA5, GABRA4, GABRP CSNK2A1 1401/4885F2 1890/4885CSNK2A2 1651/4885
US-20160108129-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-20130302359-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-20170044266-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-20120244171-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885
US-20190263924-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 CSNK2A1 1225/4885F2 3599/4885CSNK2A2 1384/4885

“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.