SCHEMBL5916623

SCHEMBL5916623

O=c1c2ccccc2[se]n1-c1ncccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 5/20 0.61
▸ HDAC6 Q9UBN7 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ QSOX1 O00391 1/20 0.51
▸ RGS12 O14924 1/20 0.51
▸ PMM2 O15305 1/20 0.51
▸ PLIN1 O60240 1/20 0.51
▸ GMNN O75496 1/20 0.51
▸ BBOX1 O75936 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ CYBB P04839 1/20 0.51
▸ BCHE P06276 1/20 0.51
▸ GLA P06280 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ MAPT P10636 1/20 0.51

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
SCHEMBL5916901 0.82 METAP2 (0.54) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL30573263 0.82 METAP2 (0.51) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL10958968 0.82 METAP2 (0.51) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL5916583 0.79 METAP2 (0.54) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL5916849 0.78 LMNA (0.48) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL5916782 0.78 METAP2 (0.61) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL10956173 0.77 METAP2 (0.53) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL10599445 0.76 METAP2 (1.00) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL28615461 0.76 METAP2 (0.57) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL29864488 0.76 METAP2 (0.44) METAP2HDAC6KDM4EMEN1QSOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060135569-A1 Use of benzisoselenazolone compounds against ischemic myocardial damage INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2006-06-22 — — US claimed
EP-1541145-A1 THE USE OF BENZISOSELENAZOLONE COMPOUNDS AGAINST ISCHEMIC MYOCARDIAL DAMAGE Institute of Materia, Chinese Academy of Medical Sciences (CN) 2005-06-15 — — EP claimed
US-20190142801-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2019-05-16 — — US disclosed
US-10172829-B2 Use of small molecules for the treatment of clostridium difficile toxicity THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2019-01-08 — — US disclosed
US-20170128420-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2017-05-11 — — US disclosed
US-20060135569-A1 Use of benzisoselenazolone compounds against ischemic myocardial damage INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2006-06-22 — — US disclosed
EP-1541145-A1 THE USE OF BENZISOSELENAZOLONE COMPOUNDS AGAINST ISCHEMIC MYOCARDIAL DAMAGE Institute of Materia, Chinese Academy of Medical Sciences (CN) 2005-06-15 — — EP disclosed
EP-0257306-B1 DISELENOBIS BENZOIC ACID AMIDES OF PRIMARY HETEROCYCLIC AMINES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOUNDS COMPRISING THE SAME A. Nattermann & Cie. GmbH (DE) 1990-09-12 — — EP disclosed
US-4910313-A Containing a heterocyclic ring NATTERMANN & CIE GMBH (DE) 1990-03-20 — — US disclosed
EP-0100899-B1 BENZISOSELENAZOLONES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1988-06-15 — — EP disclosed
EP-0257306-A1 Diselenobis benzoic acid amides of primary heterocyclic amines, process for producing the same and pharmaceutical compounds comprising the same A. Nattermann & Cie. GmbH (DE) 1988-03-02 — — EP disclosed
US-4550168-A Benzisoselenazolones and a process for the treatment of inflammatory diseases A. NATTERMANN & CIE GMBH (DE) 1985-10-29 — — US disclosed
EP-0100899-A2 Benzisoselenazolones, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1984-02-22 — — EP 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 (4 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-10172829-B2 Use of small molecules for the treatment of clostridium difficile toxicity SLC10A2, TCERG1, SBDS METAP2 1571/4885HDAC6 246/4885KDM4E 2185/4885
US-20190142801-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY SLC10A2, TCERG1, SBDS METAP2 1571/4885HDAC6 246/4885KDM4E 2185/4885
US-20170128420-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY SLC10A2, TCERG1, SBDS METAP2 1571/4885HDAC6 246/4885KDM4E 2185/4885
US-20060135569-A1 Use of benzisoselenazolone compounds against ischemic myocardial damage TNNI3, TNNT2, MYLK2 METAP2 4321/4885HDAC6 801/4885KDM4E 2585/4885

“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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