SCHEMBL1249327

SCHEMBL1249327

O=C(CCCOc1ccc(C=C2SC(=O)NC2=O)cc1)NCc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 3/20 0.57
HPGD P15428 8/20 0.53
PIM1 P11309 2/20 0.53
PIM2 Q9P1W9 2/20 0.53
GPR35 Q9HC97 1/20 0.52
CNR1 P21554 1/20 0.52
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50
KMT2A Q03164 1/20 0.50
HRH3 Q9Y5N1 1/20 0.49
PTPN1 P18031 1/20 0.49

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
SCHEMBL1249325 1.00 CISD1 (0.57) CISD1HPGDPIM1PIM2GPR35
SCHEMBL12892305 1.00 CISD1 (0.57) CISD1HPGDPIM1PIM2GPR35
SCHEMBL1250750 0.91 CNR1 (0.67) CISD1HPGDPIM1PIM2CNR1
SCHEMBL1250753 0.91 CNR1 (0.67) CISD1HPGDPIM1PIM2CNR1
SCHEMBL12892309 0.91 CNR1 (0.67) CISD1HPGDPIM1PIM2CNR1
SCHEMBL12892304 0.88 HPGD (0.60) HPGD
SCHEMBL1249178 0.88 HPGD (0.60) HPGD
SCHEMBL1249180 0.88 HPGD (0.60) HPGD
SCHEMBL1250435 0.86 HPGD (0.57) HPGDCNR1PTPN1
SCHEMBL12892311 0.86 HPGD (0.57) HPGDCNR1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879893-B2 Zinc binding ligand; sustained release of insulin NOVO NORDISK A/S (DK) 2011-02-01 US disclosed
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
EP-1429763-B1 NOVEL LIGANDS FOR THE HisB10 Zn2+ SITES OF THE R-STATE INSULIN HEXAMER NOVO NORDISK AS (DK) 2007-05-30 EP disclosed
US-20060258561-A1 Novel NPH insulin preparations NOVO NORDISK A/S (DK) 2006-11-16 US disclosed
US-20060069013-A1 Pharmaceutical preparations comprising acid-stabilised insulin NOVO NORDISK A/S (DK) 2006-03-30 US 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
US-20030229120-A1 Novel ligands for the hisb10 zn2+ sites of the r-state insulin hexamer NOVO NORDISK A/S (DK) 2003-12-11 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 (5 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 CISD1 935/4885HPGD 3521/4885PIM1 3313/4885
US-20060069013-A1 Pharmaceutical preparations comprising acid-stabilised insulin IAPP, GPR119, INSR CISD1 894/4885HPGD 2233/4885PIM1 4279/4885
US-20030229120-A1 Novel ligands for the hisb10 zn2+ sites of the r-state insulin hexamer IAPP, IRS1, GPR119 CISD1 591/4885HPGD 3173/4885PIM1 4412/4885
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 CISD1 1232/4885HPGD 4068/4885PIM1 3653/4885
US-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB CISD1 1672/4885HPGD 3478/4885PIM1 3773/4885

“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.