SCHEMBL2154075

SCHEMBL2154075

CC(C)(C)OC(=O)N1CC(OC(=O)N2Cc3cccc(F)c3C2)CC1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
UCHL1 P09936 2/20 0.42
DPP8 Q6V1X1 2/20 0.38
DPP9 Q86TI2 2/20 0.38
DPP7 Q9UHL4 2/20 0.38
MAPK1 P28482 1/20 0.38
HPGDS O60760 1/20 0.38
NAMPT P43490 1/20 0.37
PRMT5 O14744 4/20 0.36
WDR77 Q9BQA1 4/20 0.36
TRAP1 Q12931 4/20 0.36
ABHD6 Q9BV23 2/20 0.36
HTRA1 Q92743 1/20 0.35
HSP90B1 P14625 2/20 0.35

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
SCHEMBL14963380 1.00 DDB1 (0.43) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL6912998 1.00 DDB1 (0.43) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL1082163 1.00 DDB1 (0.43) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL6887144 0.91 DDB1 (0.43) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL12725885 0.91 DDB1 (0.44) DDB1CRBNUCHL1MAPK1HPGDS
SCHEMBL14963381 0.90 DDB1 (0.42) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL2805310 0.90 DDB1 (0.42) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL6913773 0.90 DDB1 (0.42) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL4655478 0.90 DDB1 (0.42) DDB1CRBNUCHL1DPP8DPP9
SCHEMBL3691732 0.89 DDB1 (0.43) DDB1CRBNUCHL1MAPK1HPGDS

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
EP-2519664-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN Avila Therapeutics, Inc. (US) 2012-11-07 EP disclosed
WO-2011082285-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN AVILA THERAPEUTICS, INC. (US) 2011-07-07 WO disclosed