SCHEMBL10599445

SCHEMBL10599445

O=c1c2ccccc2[se]n1-c1ccccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 5/20 1.00
▸ MPI P34949 2/20 0.59
▸ PHOSPHO1 Q8TCT1 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ QSOX1 O00391 1/20 0.59
▸ RGS12 O14924 1/20 0.59
▸ PMM2 O15305 1/20 0.59
▸ PLIN1 O60240 1/20 0.59
▸ GMNN O75496 1/20 0.59
▸ BBOX1 O75936 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ LMNA P02545 1/20 0.59
▸ TP53 P04637 1/20 0.59
▸ CYBB P04839 1/20 0.59
▸ BCHE P06276 1/20 0.59
▸ GLA P06280 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2D6 P10635 1/20 0.59

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
SCHEMBL10501611 0.79 METAP2 (0.66) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL29261063 0.79 METAP2 (0.66) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL30530466 0.79 METAP2 (0.66) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10501917 0.79 METAP2 (0.68) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10501672 0.79 MPI (0.72) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL30988556 0.79 METAP2 (0.65) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10873365 0.79 METAP2 (0.65) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL28618904 0.78 METAP2 (0.64) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL10956493 0.77 METAP2 (0.62) METAP2MPIPHOSPHO1KDM4EMEN1
SCHEMBL5916623 0.76 METAP2 (0.61) METAP2MPIPHOSPHO1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0198277-B1 DISELENO-BIS-BENZAMIDES OF PRIMARY AND SECONDARY AMINES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1989-05-03 — — EP disclosed
EP-0198277-A1 Diseleno-bis-benzamides of primary and secondary amines, processes for their production and pharmaceutical preparations containing them A. Nattermann & Cie. GmbH (DE) 1986-10-22 — — EP disclosed
EP-0044453-B1 NEW BENZISOSELENAZOLONES, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME A. Nattermann & Cie. GmbH (DE) 1984-04-11 — — EP disclosed
US-4418069-A Benzisoselenazolones and process for the treatment of rheumatic and arthritic diseases using them A. NATTERMANN & CIE GMBH (DE) 1983-11-29 — — US disclosed
EP-0044453-A2 New benzisoselenazolones, process for producing the same and pharmaceutical preparations containing the same A. Nattermann & Cie. GmbH (DE) 1982-01-27 — — 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 (3 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 1571/4885MPI 4658/4885PHOSPHO1 2163/4885
US-20190142801-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY SLC10A2, TCERG1, SBDS METAP2 1571/4885MPI 4658/4885PHOSPHO1 2163/4885
US-20170128420-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY SLC10A2, TCERG1, SBDS METAP2 1571/4885MPI 4658/4885PHOSPHO1 2163/4885

“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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