SCHEMBL17831720

SCHEMBL17831720

NOC(=O)C[C@H]1C[C@@H](CO)C1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
NR1H2 P55055 1/20 0.33
SLC6A12 P48065 3/20 0.32
SLC6A11 P48066 3/20 0.32
SLC6A13 Q9NSD5 3/20 0.32

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
SCHEMBL1966116 0.78 BRD4 (0.44) EPHX2NR1H2
SCHEMBL17891872 0.78 BRD4 (0.44) EPHX2NR1H2
SCHEMBL338176 0.78 BRD4 (0.44) EPHX2NR1H2
SCHEMBL27889839 0.77
SCHEMBL1924098 0.75 EPHX2 (0.41) EPHX2NR1H2SLC6A12SLC6A11SLC6A13
Hydrochloric Acid SCHEMBL28821979 0.75
SCHEMBL27980219 0.75
SCHEMBL337975 0.75 EPHX2 (0.41) EPHX2NR1H2SLC6A12SLC6A11SLC6A13
SCHEMBL17891868 0.74 NR1H2 (0.51) EPHX2NR1H2
SCHEMBL17891867 0.74 NR1H2 (0.51) EPHX2NR1H2

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
WO-2016093342-A1 DIHYDROPYRIMIDINE-2-ONE COMPOUNDS AND MEDICINAL USES THEREOF 日本たばこ産業株式会社 2016-06-16 WO disclosed