SCHEMBL464396

SCHEMBL464396

CCOCC(CO)OC(C)C(=O)Sc1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
HPGD P15428 4/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
HSD17B10 Q99714 2/20 0.38
ALDH1A1 P00352 5/20 0.34
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 4/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 0.33
ATM Q13315 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
SCHEMBL464425 0.70 HPGD (0.49) LMNAHPGDKMT2AMEN1TSHR
SCHEMBL419934 0.70 LMNA (0.52) LMNAHPGDKMT2AMEN1SMN1; SMN2
SCHEMBL7102145 0.69 HPGD (0.42) LMNAHPGDKMT2AMEN1TSHR
SCHEMBL421283 0.68 LMNA (0.39) LMNAHPGDKMT2AMEN1TSHR
SCHEMBL277446 0.68 LMNA (0.50) LMNAHPGDKMT2AMEN1SMN1; SMN2
SCHEMBL13030806 0.65 LMNA (0.39) LMNAHPGDKMT2AMEN1TSHR
SCHEMBL1607377 0.65 LMNA (0.51) LMNAHPGDKMT2AMEN1SMN1; SMN2
SCHEMBL535804 0.64 ALDH1A1 (0.49) LMNAHPGDKMT2AMEN1SMN1; SMN2
SCHEMBL10066895 0.64 LMNA (0.44) LMNAHPGDKMT2AMEN1TSHR
SCHEMBL10035712 0.64 LMNA (0.44) LMNAHPGDKMT2AMEN1TSHR

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 6 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

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 2605/4885HPGD 1334/4885KMT2A 2283/4885
US-20120065330-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith PCTP, CETP, NGLY1 LMNA 2605/4885HPGD 1334/4885KMT2A 2283/4885

“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.