SCHEMBL193047

SCHEMBL193047

O=c1c2ccccc2[se]n1-c1ccc(-c2ccc(-n3[se]c4ccccc4c3=O)cc2)cc1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 4/20 0.79
HDAC6 Q9UBN7 2/20 0.79
KDM4E B2RXH2 1/20 0.79
MEN1 O00255 1/20 0.79
QSOX1 O00391 1/20 0.79
RGS12 O14924 1/20 0.79
PMM2 O15305 1/20 0.79
PLIN1 O60240 1/20 0.79
GMNN O75496 1/20 0.79
BBOX1 O75936 1/20 0.79
ALDH1A1 P00352 1/20 0.79
LMNA P02545 1/20 0.79
TP53 P04637 1/20 0.79
CYBB P04839 1/20 0.79
BCHE P06276 1/20 0.79
GLA P06280 1/20 0.79
POLB P06746 1/20 0.79
CYP3A4 P08684 1/20 0.79
CYP2D6 P10635 1/20 0.79
MAPT P10636 1/20 0.79

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
Ebselen SCHEMBL33829 0.89 METAP2 (1.00) METAP2HDAC6KDM4EMEN1QSOX1
Ebselen SCHEMBL4406056 0.89 METAP2 (1.00) METAP2HDAC6KDM4EMEN1QSOX1
Ebselen SCHEMBL29370082 0.89 METAP2 (1.00) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL28783439 0.87 METAP2 (0.77) METAP2HDAC6KDM4EMEN1QSOX1
Ebselen SCHEMBL20678555 0.87 METAP2 (0.96) METAP2HDAC6KDM4EMEN1QSOX1
Ebselen SCHEMBL19064566 0.87 METAP2 (0.96) METAP2HDAC6KDM4EMEN1QSOX1
Ebselen SCHEMBL20477111 0.87 METAP2 (0.96) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL10501092 0.86 METAP2 (1.00) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL30573251 0.86 METAP2 (0.74) METAP2HDAC6KDM4EMEN1QSOX1
SCHEMBL10502294 0.86 METAP2 (1.00) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8609702-B2 Benzoisoselenazole derivatives with anti-inflammation, antivirus and antithrombosis activity and their use PEKING UNIVERSITY (CN) 2013-12-17 US disclosed
EP-1422225-B1 BENZOISOSELENAZOLE DERIVATIVES WITH ANTI-INFLAMMATION, ANTINEOPLASTIC AND ANTI-THROMBOSIS ACTIVITY AND THEIR USE UNIV BEIJING (CN) 2012-01-04 EP disclosed
US-7820829-B2 Bisbenzisoselenazolonyl derivatives having antineoplastic, anti-inflammatory and antithrombotic activities as well as their use PEKING UNIVERSITY (CN) 2010-10-26 US disclosed
US-20090123567-A1 BISBENZISOSELENAZOLONYL DERIVATIVES HAVING ANTINEOPLASTIC, ANTI-INFLAMMATORY AND ANTITHROMBOTIC ACTIVITIES AS WELL AS THEIR USE PEKING UNIVERSITY (CN) 2009-05-14 US disclosed
US-20090117204-A1 BENZOISOSELENAZOLE DERIVATIVES WITH ANTI-INFLAMMATION, ANTIVIRUS AND ANTITHROMBOSIS ACTIVITY AND THEIR USE PEKING UNIVERSITY (CN) 2009-05-07 US disclosed
US-7495019-B2 Benzoisoselenazole derivatives with anti-inflammation, antivirus and antithrombosis activity and their use PEKING UNIVERSITY (CN) 2009-02-24 US disclosed
EP-1422225-A1 BENZOISOSELENAZOLE DERIVATIVES WITH ANTI-INFLAMMATION, ANTIVIRUS AND ANTI-THROMBOSIS ACTIVITY AND THEIR USE Peking University (CN) 2004-05-26 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 (2 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-20090117204-A1 BENZOISOSELENAZOLE DERIVATIVES WITH ANTI-INFLAMMATION, ANTIVIRUS AND ANTITHROMBOSIS ACTIVITY AND THEIR USE SERPINC1, IL33, SERPINB1 METAP2 2603/4885HDAC6 476/4885KDM4E 2388/4885
US-20090123567-A1 BISBENZISOSELENAZOLONYL DERIVATIVES HAVING ANTINEOPLASTIC, ANTI-INFLAMMATORY AND ANTITHROMBOTIC ACTIVITIES AS WELL AS THEIR USE SERPINC1, NFKBIA, IL1B METAP2 2982/4885HDAC6 332/4885KDM4E 2984/4885

“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.