SCHEMBL13619023

SCHEMBL13619023

CC1CC(c2ccc3c(c2)CNC3)CC(C)O1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
IDH1 O75874 1/20 0.30

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
SCHEMBL3871615 1.00 DDB1 (0.40) DDB1CRBNTLR9TLR8TLR7
SCHEMBL8262288 1.00 DDB1 (0.40) DDB1CRBNTLR9TLR8TLR7
SCHEMBL31122203 0.76 DDB1 (0.51) DDB1CRBN
SCHEMBL25693522 0.75 DDB1 (0.44) DDB1CRBN
Hydrochloric Acid SCHEMBL31210159 0.74 DDB1 (0.50) DDB1CRBN
SCHEMBL1095482 0.72 DDB1 (0.45) DDB1CRBN
Hydrochloric Acid SCHEMBL3882894 0.71 DDB1 (0.44) DDB1CRBN
SCHEMBL3879144 0.70 DDB1 (0.43) DDB1CRBNIDH1
SCHEMBL3885452 0.68 DDB1 (0.41) DDB1CRBNIDH1
SCHEMBL3872150 0.68 DDB1 (0.41) DDB1CRBNIDH1

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-1848694-B1 HETEROCYCLIC SUBSTITUTED PHENYL METHANONES AS INHIBITORS OF THE GLYCINE TRANSPORTER 1 HOFFMANN LA ROCHE (CH) 2009-11-25 EP disclosed