SCHEMBL23939725

SCHEMBL23939725

CC(C)(C)OC(=O)NCC1OB(O)c2c(OI)ccc(F)c21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RPS6KA1 Q15418 1/20 0.37
LARS1 Q9P2J5 5/20 0.33
EPAS1 Q99814 1/20 0.33
EPHX2 P34913 1/20 0.31
AAK1 Q2M2I8 1/20 0.31

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
SCHEMBL23939724 0.91 LARS1 (0.43) RPS6KA1LARS1EPAS1
SCHEMBL469420 0.89 LARS1 (0.45) RPS6KA1LARS1
SCHEMBL469421 0.89 LARS1 (0.45) RPS6KA1LARS1
SCHEMBL469422 0.89 LARS1 (0.45) RPS6KA1LARS1
SCHEMBL23939741 0.88 LARS1 (0.46) LARS1
SCHEMBL19017151 0.88 LARS1 (0.47) LARS1
SCHEMBL23939723 0.81 RPS6KA1 (0.40) RPS6KA1EPHX2
SCHEMBL19672999 0.81 RPS6KA1 (0.40) RPS6KA1EPHX2
SCHEMBL21570015 0.79 LARS1 (0.43) RPS6KA1LARS1
SCHEMBL23939742 0.78 LARS1 (0.47) LARS1

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-3251678-B1 BENZOXABOROLE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS ANACOR PHARMACEUTICALS INC (US) 2021-10-20 EP disclosed