SCHEMBL6929411

SCHEMBL6929411

O=C1NC(=O)/C(=C\c2ccccc2C(=O)O)S1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.74
NAT1 P18440 1/20 0.66
TTR P02766 3/20 0.61
IGF1R P08069 1/20 0.61
PIM1 P11309 2/20 0.61
PIM3 Q86V86 2/20 0.61
PIM2 Q9P1W9 2/20 0.61
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
AKR1B1 P15121 3/20 0.58
GSK3B P49841 2/20 0.57
TDP2 O95551 1/20 0.56
CASP7 P55210 1/20 0.56
CASP9 P55211 1/20 0.56
CASP6 P55212 1/20 0.56
CASP8 Q14790 1/20 0.56
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
POLB P06746 2/20 0.54
BLM P54132 1/20 0.54

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
SCHEMBL6929414 1.00 TDP1 (0.74) TDP1NAT1TTRIGF1RPIM1
SCHEMBL18103098 0.85 NAT1 (0.68) TDP1NAT1PIM1GSK3B
SCHEMBL11730105 0.85 NAT1 (0.68) TDP1NAT1PIM1GSK3B
SCHEMBL14860997 0.85 TDP1 (1.00) TDP1MEN1KMT2ATDP2ALDH1A1
SCHEMBL14860994 0.85 TDP1 (1.00) TDP1MEN1KMT2ATDP2ALDH1A1
SCHEMBL6419026 0.85 TDP1 (0.59) TDP1NAT1TTRIGF1RPIM1
SCHEMBL6419028 0.85 TDP1 (0.59) TDP1NAT1TTRIGF1RPIM1
SCHEMBL14860995 0.85 TDP1 (1.00) TDP1MEN1KMT2ATDP2ALDH1A1
SCHEMBL1248983 0.85 KMT2A (0.59) TDP1NAT1TTRIGF1RPIM1
SCHEMBL1248985 0.85 KMT2A (0.59) TDP1NAT1TTRIGF1RPIM1

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 7 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
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-6518268-B1 Telomerase inhibitors and methods of their use GERON CORPORATION 2003-02-11 US disclosed
WO-2001002377-A9 TELOMERASE INHIBITORS AND METHODS OF THEIR USE GERON CORP (US) 2001-10-11 WO disclosed
EP-1109796-A1 TELOMERASE INHIBITORS AND METHODS OF THEIR USE Geron Corporation (US) 2001-06-27 EP disclosed
WO-2001002377-A1 TELOMERASE INHIBITORS AND METHODS OF THEIR USE GERON CORPORATION (US) 2001-01-11 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-20090123563-A1 Pharmaceutical Preparations Comprising Insulin, Zinc Ions and Zinc-Binding Ligand IAPP, IRS1, HBB TDP1 4829/4885NAT1 4542/4885TTR 62/4885

“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.