SCHEMBL17688732

SCHEMBL17688732

O=S(O)C/C=C\CSSC/C=C\CS(=O)O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 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
SCHEMBL17688734 1.00 PTGS2 (0.33) PTGS2
SCHEMBL27449958 0.91
SCHEMBL10776738 0.80 MEN1 (0.33)
SCHEMBL17688646 0.75 HDAC2 (0.35)
SCHEMBL17688648 0.75 HDAC2 (0.35)
SCHEMBL27449960 0.75 HDAC2 (0.30)
SCHEMBL10012291 0.70
SCHEMBL2363187 0.69
SCHEMBL10012809 0.67
SCHEMBL7040560 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170240570-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2017-08-24 US claimed
EP-3207036-A2 NOVEL SMALL MOLECULE ANTICANCER AGENTS University of Florida Research Foundation (US) 2017-08-23 EP claimed
WO-2016061555-A2 NOVEL SMALL MOLECULE ANTICANCER AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2016-04-21 WO claimed
US-12030864-B2 Small molecule anticancer agents, combinations and uses thereof UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-07-09 US disclosed
US-12030864-B2 Small molecule anticancer agents, combinations and uses thereof UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-07-09 US disclosed
US-20210147379-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS, COMBINATIONS AND USES THEREOF University of Florda Research Foundation,Incorporated (US) 2021-05-20 US disclosed
US-20210147379-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS, COMBINATIONS AND USES THEREOF University of Florda Research Foundation,Incorporated (US) 2021-05-20 US disclosed
US-20170240570-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2017-08-24 US disclosed
US-20170240570-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2017-08-24 US disclosed
EP-3207036-A2 NOVEL SMALL MOLECULE ANTICANCER AGENTS University of Florida Research Foundation (US) 2017-08-23 EP disclosed
WO-2016061555-A2 NOVEL SMALL MOLECULE ANTICANCER AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2016-04-21 WO disclosed
WO-2016061555-A2 NOVEL SMALL MOLECULE ANTICANCER AGENTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2016-04-21 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 (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-20210147379-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS, COMBINATIONS AND USES THEREOF MKI67, TP53, PLK1 PTGS2 1736/4885
US-12030864-B2 Small molecule anticancer agents, combinations and uses thereof MKI67, TP53, PCNA PTGS2 1400/4885
US-20170240570-A1 NOVEL SMALL MOLECULE ANTICANCER AGENTS MKI67, TP53, PCNA PTGS2 1638/4885

“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.