SCHEMBL29348585

SCHEMBL29348585

O=C1CCC(c2cccc(-c3cnc(N4CCCCC4=O)c(F)c3)c2Cl)C(=O)N1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.40
DDB1 Q16531 11/20 0.38
CRBN Q96SW2 11/20 0.38
ALOX5AP P20292 2/20 0.37
FEN1 P39748 1/20 0.34
IKZF3 Q9UKT9 4/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33

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
SCHEMBL31068362 1.00 CNR2 (0.40) CNR2DDB1CRBNALOX5APFEN1
SCHEMBL29348597 0.87 DDB1 (0.40) CNR2DDB1CRBNOPRM1OPRL1
SCHEMBL31068225 0.87 DDB1 (0.40) CNR2DDB1CRBNOPRM1OPRL1
SCHEMBL29348666 0.87 ALOX5AP (0.37) CNR2DDB1CRBNALOX5APFEN1
SCHEMBL29348867 0.85 DDB1 (0.37) CNR2DDB1CRBNIKZF3OPRM1
SCHEMBL29348994 0.84 CNR2 (0.59) CNR2DDB1CRBN
SCHEMBL31068267 0.84 CNR2 (0.59) CNR2DDB1CRBN
SCHEMBL31068144 0.83 DDB1 (0.37) CNR2DDB1CRBNIKZF3OPRM1
SCHEMBL29348582 0.83 DDB1 (0.37) CNR2DDB1CRBNIKZF3OPRM1
SCHEMBL31068230 0.83 DDB1 (0.38) DDB1CRBNIKZF3OPRM1OPRL1

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-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed