SCHEMBL2539676

SCHEMBL2539676

Cc1cccc(/C=C2\SC(=O)NC2=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 10/20 1.00
PIM2 Q9P1W9 10/20 1.00
NAT1 P18440 1/20 0.74
HPGD P15428 1/20 0.71
AKR1B1 P15121 4/20 0.68
CISD1 Q9NZ45 3/20 0.68
MAOA P21397 1/20 0.68
MAOB P27338 1/20 0.68
PIM3 Q86V86 2/20 0.68
GSK3B P49841 1/20 0.68
TTR P02766 2/20 0.63
IGF1R P08069 2/20 0.62
PDE4B Q07343 1/20 0.58

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
SCHEMBL2539680 1.00 PIM1 (1.00) PIM1PIM2NAT1HPGDAKR1B1
SCHEMBL2539679 1.00 PIM1 (1.00) PIM1PIM2NAT1HPGDAKR1B1
SCHEMBL7557609 0.85 NAT1 (1.00) PIM1PIM2NAT1CISD1GSK3B
SCHEMBL7557614 0.85 NAT1 (1.00) PIM1PIM2NAT1CISD1GSK3B
SCHEMBL2545594 0.83 PIM1 (1.00) PIM1PIM2HPGDAKR1B1CISD1
SCHEMBL2547566 0.83 PIM1 (1.00) PIM1PIM2HPGDAKR1B1CISD1
SCHEMBL2545596 0.83 PIM1 (1.00) PIM1PIM2HPGDAKR1B1CISD1
SCHEMBL1250348 0.83 PIM1 (1.00) PIM1PIM2AKR1B1CISD1MAOA
SCHEMBL2548389 0.83 PIM1 (1.00) PIM1PIM2AKR1B1CISD1MAOA
SCHEMBL1250346 0.83 PIM1 (1.00) PIM1PIM2AKR1B1CISD1MAOA

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 19 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 claimed
EP-2217235-A2 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER Musc Foundation for Research Development (US) 2010-08-18 EP claimed
WO-2009064486-A9 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER MUSC FOUND FOR RES DEV (US) 2009-07-16 WO claimed
WO-2009064486-A2 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2009-05-22 WO claimed
EP-1214305-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION Maxia Pharmaceuticals, Inc. (US) 2002-06-19 EP claimed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO claimed
US-8790855-B2 Charge control agent and toner using same HODOGAYA CHEMICAL CO., LTD (JP) 2014-07-29 US disclosed
US-8790855-B2 Charge control agent and toner using same HODOGAYA CHEMICAL CO., LTD (JP) 2014-07-29 US disclosed
EP-2618218-A1 CHARGE CONTROL AGENT AND TONER USING SAME Hodogaya Chemical Co., Ltd. (JP) 2013-07-24 EP disclosed
US-20130177843-A1 CHARGE CONTROL AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2013-07-11 US disclosed
US-20130177843-A1 CHARGE CONTROL AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2013-07-11 US disclosed
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
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
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
US-20100035957-A1 Methods for the Use of Inhibitors of Cytosolic Phospholipase A2 WYETH 2010-02-11 US 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
US-7262318-B2 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER, INC. (US) 2007-08-28 US 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-20110263664-A1 Inhibitors of PIM-1 Protein Kinases, Compositions and Methods for Treating Prostate Cancer PIM1, PIM2, PIM3 PIM1 1/4885PIM2 2/4885NAT1 3056/4885
US-20100035957-A1 Methods for the Use of Inhibitors of Cytosolic Phospholipase A2 PLA2G4A, PLA2G4B, PLA2G1B PIM1 1622/4885PIM2 782/4885NAT1 934/4885

“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.