SCHEMBL2548313

SCHEMBL2548313

O=C1NC(=O)/C(=C\c2cccc(Br)c2)S1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 9/20 1.00
PIM2 Q9P1W9 9/20 1.00
CISD1 Q9NZ45 5/20 1.00
MAOA P21397 2/20 1.00
MAOB P27338 2/20 1.00
PNP P00491 1/20 0.74
AKR1B1 P15121 4/20 0.68
PIM3 Q86V86 1/20 0.68
TTR P02766 1/20 0.63
GSK3B P49841 1/20 0.63
IGF1R P08069 1/20 0.62

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
SCHEMBL1249973 1.00 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL1249975 1.00 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL7562042 0.85 CISD1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL7562040 0.85 CISD1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL2544417 0.83 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL1250573 0.83 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL1250576 0.83 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL1250348 0.83 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL2548389 0.83 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB
SCHEMBL1250346 0.83 PIM1 (1.00) PIM1PIM2CISD1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263664-A1 Inhibitors of PIM-1 Protein Kinases, Compositions and Methods for Treating Prostate Cancer MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2011-10-27 US disclosed
EP-2217235-A2 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER Musc Foundation for Research Development (US) 2010-08-18 EP disclosed
WO-2009064486-A9 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER MUSC FOUND FOR RES DEV (US) 2009-07-16 WO disclosed
WO-2009064486-A2 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2009-05-22 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-20110263664-A1 Inhibitors of PIM-1 Protein Kinases, Compositions and Methods for Treating Prostate Cancer PIM1, PIM2, PIM3 PIM1 1/4885PIM2 2/4885CISD1 3097/4885

“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.