SCHEMBL18924055

SCHEMBL18924055

COC(=O)C1CCC(C(=O)NCC(=O)NCC(=O)NCC(=O)OCC(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 3/20 0.44
MTNR1A P48039 6/20 0.36
MTNR1B P49286 6/20 0.36
GAA P10253 1/20 0.35
HTT P42858 2/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL18924053 0.80 PSMB5 (0.38) PSMB5GAAHTTALDH1A1KDM4E
SCHEMBL18924125 0.79 PSMB5 (0.41) PSMB5MTNR1AMTNR1BGAAHTT
SCHEMBL17570904 0.79 PSMB5 (0.41) PSMB5MTNR1AMTNR1BGAAHTT
SCHEMBL1296672 0.76 ADRB2 (0.44) GAAALDH1A1POLBMAPTTSHR
SCHEMBL20882707 0.73 GAA (0.46) PSMB5GAAALDH1A1KMT2ATSHR
SCHEMBL18924054 0.72 GAA (0.39) PSMB5GAAALDH1A1KMT2APOLB
SCHEMBL2576766 0.72 KMT2A (0.44) PSMB5GAAALDH1A1KDM4EHSD17B10
SCHEMBL2576767 0.72 KMT2A (0.44) PSMB5GAAALDH1A1KDM4EHSD17B10
SCHEMBL16825248 0.70 GAA (0.51) GAAHTTALDH1A1KDM4EHSD17B10
SCHEMBL2576721 0.69 MTNR1A (0.46) PSMB5MTNR1AMTNR1BGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233697-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2023-07-27 US disclosed
US-11116845-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2021-09-14 US disclosed
EP-3778601-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES ImmunoGen, Inc. (US) 2021-02-17 EP disclosed
US-20200405870-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2020-12-31 US disclosed
US-10722588-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2020-07-28 US disclosed
EP-3189056-B1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN INC (US) 2020-06-10 EP disclosed
US-20190269786-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2019-09-05 US disclosed
US-10238751-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2019-03-26 US disclosed
US-20170340748-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2017-11-30 US disclosed
US-9669102-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2017-06-06 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 (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-10238751-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885
US-11116845-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885
US-20200405870-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885
US-20230233697-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885
US-10722588-B2 Cytotoxic benzodiazepine derivatives GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885
US-20190269786-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885
US-20170340748-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 PSMB5 1114/4885MTNR1A 340/4885MTNR1B 129/4885

“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.