SCHEMBL4253015

SCHEMBL4253015

NCCCC[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SARS1 P49591 1/20 0.81
RARS1 P54136 1/20 0.81
MARS1 P56192 1/20 0.79
LARS1 Q9P2J5 2/20 0.78
TARS1 P26639 2/20 0.75
IARS1 P41252 1/20 0.72
HARS1 P12081 1/20 0.70

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
SCHEMBL29390953 1.00 SARS1 (0.81) SARS1RARS1MARS1LARS1TARS1
SCHEMBL13773213 0.92 MARS1 (0.82) SARS1RARS1MARS1LARS1TARS1
SCHEMBL13773214 0.92 MARS1 (0.82) SARS1RARS1MARS1LARS1TARS1
SCHEMBL13773212 0.92 MARS1 (0.82) SARS1RARS1MARS1LARS1TARS1
SCHEMBL13773209 0.91 MARS1 (0.84) SARS1RARS1MARS1LARS1TARS1
SCHEMBL13773211 0.91 MARS1 (0.84) SARS1RARS1MARS1LARS1TARS1
SCHEMBL13773210 0.91 MARS1 (0.84) SARS1RARS1MARS1LARS1TARS1
SCHEMBL5063189 0.90 SARS1 (0.82) SARS1RARS1MARS1LARS1TARS1
SCHEMBL5063184 0.90 SARS1 (0.82) SARS1RARS1MARS1LARS1TARS1
SCHEMBL3500697 0.90 SARS1 (0.82) SARS1RARS1MARS1LARS1TARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227209-B2 Process for producing functional non-naturally occurring proteins, and method for site-specific modification and immobilization of the proteins TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-07-24 US disclosed
US-20090011459-A1 Process for producing functional non-naturally occurring proteins, and method for site-specific modification and immobilization of the proteins TOKYO INSTITUTE OF TECHNOLOGY 2009-01-08 US disclosed