SCHEMBL5853306

SCHEMBL5853306

Cc1nn(C(=O)OC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 6/20 0.33
UCHL1 P09936 1/20 0.32
P4HB P07237 1/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 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
SCHEMBL482174 0.83 USP30 (0.37) UCHL1NR1H2
SCHEMBL6644374 0.78 FFAR1 (0.43) LIPEP4HBLPLLIPG
SCHEMBL2209141 0.77 UCHL1 (0.34) UCHL1P4HBLPLLIPG
SCHEMBL32685024 0.75 SCD (0.39) LIPELPLLIPG
SCHEMBL6644376 0.73 LIPG (0.40) P4HBLPLLIPG
SCHEMBL1094283 0.73 LPL (0.36) LPLLIPG
SCHEMBL30241906 0.72 UCHL1 (0.39) UCHL1LPLLIPGNR1H2
SCHEMBL18013721 0.70 USP30 (0.36) UCHL1NR1H2
SCHEMBL31258155 0.70 USP30 (0.40) LIPEUCHL1NR1H2
SCHEMBL32684434 0.69 USP30 (0.36) UCHL1NR1H2

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
US-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed