SCHEMBL3419151

SCHEMBL3419151

COC(=O)[C@@H]1COCN1C(=O)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.49
MITF O75030 1/20 0.48
MAPT P10636 1/20 0.48
HTT P42858 1/20 0.48
PREP P48147 4/20 0.47
NPSR1 Q6W5P4 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
FKBP1A P62942 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KLK7 P49862 2/20 0.45
KLK5 Q9Y337 1/20 0.45
HTR2C P28335 1/20 0.45
CPB1 P15086 1/20 0.45
ALDH1A1 P00352 1/20 0.44
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44

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
SCHEMBL28880336 1.00 OPRL1 (0.49) OPRL1MITFMAPTHTTPREP
SCHEMBL2072837 0.88 NPSR1 (0.54) MITFMAPTHTTPREPNPSR1
SCHEMBL13259971 0.87 MEN1 (0.49) OPRL1PREPNPSR1MEN1KMT2A
SCHEMBL3148090 0.87 MEN1 (0.51) OPRL1PREPNPSR1MEN1KMT2A
SCHEMBL628051 0.87 MEN1 (0.51) OPRL1PREPNPSR1MEN1KMT2A
SCHEMBL628052 0.87 MEN1 (0.51) OPRL1PREPNPSR1MEN1KMT2A
SCHEMBL1864842 0.83 POLB (0.52) MITFMAPTHTTPREPNPSR1
SCHEMBL7802196 0.83 POLB (0.52) MITFMAPTHTTPREPNPSR1
SCHEMBL2300448 0.83 POLB (0.52) MITFMAPTHTTPREPNPSR1
SCHEMBL15307912 0.82 HTR2C (0.56) PREPNPSR1MEN1KMT2ANPC1

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11505617-B2 Benzodiazepine derivatives IMMUNOGEN, INC. (US) 2022-11-22 US disclosed
CN-108727407-B Novel benzodiazepine derivatives 伊缪诺金公司 2022-01-28 CN disclosed
US-20210238301-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2021-08-05 US disclosed
US-10947315-B2 Benzodiazepine derivatives IMMUNOGEN, INC. (US) 2021-03-16 US disclosed
CN-105198908-B Novel benzodiazepine derivatives 伊缪诺金公司 2019-12-24 CN disclosed
US-20190276552-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2019-09-12 US disclosed
US-10208127-B2 Benzodiazepine derivatives IMMUNOGEN, INC. (US) 2019-02-19 US disclosed
US-20180355055-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2018-12-13 US disclosed
CN-108727407-A Novel benzodiazepine * derivatives 伊缪诺金公司 2018-11-02 CN disclosed
EP-3100745-B1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2018-04-18 EP disclosed
US-8426402-B2 Benzodiazepine derivatives IMMUNOGEN, INC. (US) 2013-04-23 US disclosed
US-8426402-B2 Benzodiazepine derivatives IMMUNOGEN, INC. (US) 2013-04-23 US disclosed
US-8426402-B2 Benzodiazepine derivatives IMMUNOGEN, INC. (US) 2013-04-23 US disclosed
CN-102365021-A Novel benzodiazepine derivatives IMMUNOGEN INC 2012-02-29 CN disclosed
EP-2393362-A1 NOVEL BENZODIAZEPINE DERIVATIVES Immunogen, Inc. (US) 2011-12-14 EP disclosed
US-20100203007-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC. (US) 2010-08-12 US disclosed
US-20100203007-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC. (US) 2010-08-12 US disclosed
US-20100203007-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC. (US) 2010-08-12 US disclosed
WO-2010091150-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2010-08-12 WO disclosed
WO-2010091150-A1 NOVEL BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. (US) 2010-08-12 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 (7 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-20210238301-A1 NOVEL BENZODIAZEPINE DERIVATIVES GABRB1, GABRB3, GABRA1 OPRL1 171/4885MITF 2990/4885MAPT 3500/4885
US-20180355055-A1 NOVEL BENZODIAZEPINE DERIVATIVES GABRB1, GABRB3, GABRA1 OPRL1 171/4885MITF 2990/4885MAPT 3500/4885
US-10208127-B2 Benzodiazepine derivatives GABBR1, GABRB1, GABRA1 OPRL1 181/4885MITF 2978/4885MAPT 3237/4885
US-20190276552-A1 NOVEL BENZODIAZEPINE DERIVATIVES GABRB1, GABRB3, GABRA1 OPRL1 171/4885MITF 2990/4885MAPT 3500/4885
US-20100203007-A1 NOVEL BENZODIAZEPINE DERIVATIVES GABRB1, GABRB3, GABRA1 OPRL1 171/4885MITF 2990/4885MAPT 3500/4885
US-11505617-B2 Benzodiazepine derivatives GABBR1, GABRB1, GABRA1 OPRL1 181/4885MITF 2978/4885MAPT 3237/4885
US-10947315-B2 Benzodiazepine derivatives GABBR1, GABRB1, GABRA1 OPRL1 181/4885MITF 2978/4885MAPT 3237/4885

“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.