SCHEMBL23927387

SCHEMBL23927387

NS(=O)(=O)OCC1CC(Nc2ncncc2C(=O)c2cc(CO)c(Cc3cccc(Cl)c3)s2)CC1O

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 20/20 0.84
UBA2 Q9UBT2 20/20 0.84
NAE1 Q13564 16/20 0.84
UBA3 Q8TBC4 16/20 0.84

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
SCHEMBL17421213 1.00 SAE1 (0.84) SAE1UBA2NAE1UBA3
SCHEMBL18995083 0.95 SAE1 (0.86) SAE1UBA2NAE1UBA3
SCHEMBL17410020 0.95 SAE1 (0.86) SAE1UBA2NAE1UBA3
SCHEMBL17410019 0.91 SAE1 (1.00) SAE1UBA2NAE1UBA3
SCHEMBL23956333 0.91 SAE1 (1.00) SAE1UBA2NAE1UBA3
SCHEMBL17421669 0.91 SAE1 (1.00) SAE1UBA2NAE1UBA3
SCHEMBL17410176 0.90 SAE1 (0.83) SAE1UBA2NAE1UBA3
SCHEMBL19204204 0.90 SAE1 (0.83) SAE1UBA2NAE1UBA3
SCHEMBL17410352 0.90 SAE1 (1.00) SAE1UBA2NAE1UBA3
SCHEMBL21204972 0.90 SAE1 (0.87) SAE1UBA2NAE1UBA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3901159-A1 HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF SUMO ACTIVATING ENZYME Millennium Pharmaceuticals, Inc. (US) 2021-10-27 EP disclosed