SCHEMBL4089557

SCHEMBL4089557

COc1ccccc1C=CC=C1SC(=O)NC1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTP4A3 O75365 1/20 0.60
NAT1 P18440 2/20 0.54
GSK3A P49840 2/20 0.54
PIM1 P11309 3/20 0.50
PIM2 Q9P1W9 3/20 0.50
TTR P02766 2/20 0.50
PIM3 Q86V86 2/20 0.50
PIK3CG P48736 1/20 0.50
PDE4B Q07343 1/20 0.50
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
PTPN1 P18031 2/20 0.49
ALDH1A1 P00352 2/20 0.48
PLA2G1B P04054 2/20 0.48
POLB P06746 2/20 0.48
HTT P42858 2/20 0.48
ATG4B Q9Y4P1 2/20 0.48
KDM4E B2RXH2 1/20 0.48
BLM P54132 1/20 0.48
AKR1B1 P15121 1/20 0.48

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
SCHEMBL13846584 1.00 PTP4A3 (0.60) PTP4A3NAT1GSK3APIM1PIM2
SCHEMBL8177375 0.86 PTP4A3 (0.77) PTP4A3NAT1GSK3APIM1PIM2
SCHEMBL8187546 0.86 PTP4A3 (0.57) PTP4A3NAT1GSK3APDE4BMEN1
SCHEMBL8181082 0.85 IGF1R (0.61) PTP4A3GSK3APIM1PIM2TTR
SCHEMBL1249948 0.84 NAT1 (0.74) NAT1GSK3APIM1PIM2TTR
SCHEMBL1249945 0.84 NAT1 (0.74) NAT1GSK3APIM1PIM2TTR
SCHEMBL30990563 0.84 NAT1 (0.74) NAT1GSK3APIM1PIM2TTR
SCHEMBL8183772 0.81 PIM1 (0.48) PTP4A3GSK3APIM1PIM2TTR
SCHEMBL8182980 0.81 PIM1 (0.51) PTP4A3NAT1PIM1TTRPIK3CG
SCHEMBL8182982 0.81 PIM1 (0.51) PTP4A3NAT1PIM1TTRPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand NOVO NORDISK A/S (DK) 2009-05-14 US disclosed
EP-1585541-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING INSULIN AND LEGENDS OF INSULIN HEXAMER NOVO NORDISK AS (DK) 2007-11-14 EP disclosed
US-20060258561-A1 Novel NPH insulin preparations NOVO NORDISK A/S (DK) 2006-11-16 US disclosed
WO-2006082245-A1 PHARMACEUTICAL PREPARATIONS COMPRISING INSULIN, ZINC IONS AND A ZINC-BINDING LIGAND NOVO NORDISK A/S (DK) 2006-08-10 WO disclosed
US-20060069013-A1 Pharmaceutical preparations comprising acid-stabilised insulin NOVO NORDISK A/S (DK) 2006-03-30 US disclosed
EP-1610812-A1 PHARMACEUTICAL PREPARATIONS COMPRISING ACID-STABILISED INSULIN NOVO NORDISK A/S (DK) 2006-01-04 EP disclosed
EP-1585541-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING INSULIN AND LEGENDS OF INSULIN HEXAMER NOVO NORDISK A/S (DK) 2005-10-19 EP disclosed
US-20050065066-A1 comprising insulin and novel ligands for the HisB10 Zn2+ sites of the R-state insulin hexamer; physical and chemical stability NOVO NORDISK A/S (DK) 2005-03-24 US disclosed
WO-2004080480-A1 PHARMACEUTICAL PREPARATIONS COMPRISING ACID-STABILISED INSULIN NOVO NORDISK A/S (DK) 2004-09-23 WO disclosed
WO-2004056347-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING INSULIN AND LEGENDS OF INSULIN HEXAMER NOVO NORDISK A/S (DK) 2004-07-08 WO disclosed
WO-2000018746-A1 THIAZOLIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS ROCHE DIAGNOSTICS GMBH (DE) 2000-04-06 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 (4 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-20060258561-A1 Novel NPH insulin preparations IAPP, HBB, INSR PTP4A3 1682/4885NAT1 2886/4885GSK3A 3980/4885
US-20060069013-A1 Pharmaceutical preparations comprising acid-stabilised insulin IAPP, GPR119, INSR PTP4A3 3124/4885NAT1 4021/4885GSK3A 4521/4885
US-20050065066-A1 comprising insulin and novel ligands for the HisB10 Zn2+ sites of the R-state insulin hexamer; physical and chemical stability IAPP, IRS1, INSR PTP4A3 2671/4885NAT1 4479/4885GSK3A 3934/4885
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB PTP4A3 1732/4885NAT1 4542/4885GSK3A 3226/4885

“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.