SCHEMBL464397

SCHEMBL464397

CCOCC(OCC(=O)Sc1ccccn1)OC(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
KMT2A Q03164 6/20 0.37
ALDH1A1 P00352 5/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.36
MEN1 O00255 4/20 0.36
HPGD P15428 4/20 0.36
RGS12 O14924 1/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALOX12 P18054 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
PKM P14618 1/20 0.34
PAX8 Q06710 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL419934 0.77 LMNA (0.52) LMNAKMT2AALDH1A1MAPTPOLB
SCHEMBL28161589 0.72 TSHR (0.46) LMNAKMT2AALDH1A1MAPTPOLB
SCHEMBL277446 0.70 LMNA (0.50) LMNAKMT2AALDH1A1MAPTPOLB
SCHEMBL13979666 0.69 LMNA (0.48) LMNAKMT2AALDH1A1MAPTPOLB
SCHEMBL1607377 0.67 LMNA (0.51) LMNAKMT2AALDH1A1MAPTPOLB
SCHEMBL27516477 0.67 TSHR (0.57) LMNAKMT2AALDH1A1MAPTMEN1
SCHEMBL9940061 0.67 LMNA (0.50) LMNAKMT2AALDH1A1POLBMEN1
SCHEMBL28391084 0.65 TSHR (0.50) LMNAKMT2AALDH1A1POLBMEN1
SCHEMBL4120039 0.65 ALDH1A1 (0.50) LMNAKMT2AALDH1A1MAPTPOLB
SCHEMBL10402708 0.65 ALDH1A1 (0.51) LMNAKMT2AALDH1A1MAPTPOLB

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-8329876-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS (US) 2012-12-11 US disclosed
US-20120065330-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith NEKTAR THERAPEUTICS (US) 2012-03-15 US disclosed
US-8071678-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS (US) 2011-12-06 US disclosed
US-20110065862-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith NEKTAR THERAPEUTICS (US) 2011-03-17 US disclosed
US-7834088-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS (US) 2010-11-16 US disclosed
US-20100069571-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith NEKTAR THERAPEUTICS (US) 2010-03-18 US disclosed
US-7511095-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-03-31 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-20100069571-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith PCTP, CETP, NGLY1 LMNA 2605/4885KMT2A 2283/4885ALDH1A1 1734/4885
US-20120065330-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith PCTP, CETP, NGLY1 LMNA 2605/4885KMT2A 2283/4885ALDH1A1 1734/4885

“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.