SCHEMBL1801732

SCHEMBL1801732

COOCC(O)COOC

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL14173060 0.91
SCHEMBL1494098 0.85
SCHEMBL14218177 0.83 MAPT (0.39) ALDH1A1TSHR
SCHEMBL21042262 0.81 TDP1 (0.44) ALDH1A1TSHR
SCHEMBL14174551 0.79
SCHEMBL135566 0.78
SCHEMBL55052 0.72
SCHEMBL809426 0.69
SCHEMBL6015151 0.67 MAPK1 (0.40) TSHR
SCHEMBL12174865 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105153115-B Zwitterionic acridinium compounds 西门子医疗保健诊断公司 2021-08-03 CN disclosed
EP-3067345-B1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC (US) 2018-09-05 EP disclosed
US-9575062-B2 Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2017-02-21 US disclosed
EP-3067345-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS Siemens Healthcare Diagnostics Inc. (US) 2016-09-14 EP disclosed
EP-2501681-B1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS (US) 2016-05-25 EP disclosed
CN-105153115-A Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS 2015-12-16 CN disclosed
CN-102762539-B Zwitterionic acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2015-07-29 CN disclosed
US-20140295575-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-10-02 US disclosed
US-8778624-B2 Zwitterion-containing acridinium compounds SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2014-07-15 US disclosed
CN-102762539-A Zwitterionic acridine compounds SIEMENS HEALTHCARE DIAGNOSTICS 2012-10-31 CN disclosed
EP-2501681-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS Siemens Healthcare Diagnostics Inc. (US) 2012-09-26 EP disclosed
US-20120225497-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2012-09-06 US disclosed
WO-2011060228-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2011-05-19 WO disclosed
US-20070237796-A1 Stable High Pl Hydrogel Compositions TEXAS A&M UNIVERSITY SYSTEM, THE 2007-10-11 US disclosed
WO-2004113432-A2 STABLE HIGH pI HYDROGEL COMPOSITIONS THE TEXAS A & M UNIVERSITY SYSTEM (US) 2004-12-29 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 (1 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-20120225497-A1 ZWITTERION-CONTAINING ACRIDINIUM COMPOUNDS ACR, SSB, FCGR3B ALDH1A1 2763/4885TSHR 1302/4885

“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.