SCHEMBL29348654

SCHEMBL29348654

O=C1CCC(c2cccc(-c3ccc(Cn4ccccc4=O)nc3)c2Cl)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 13/20 0.39
CRBN Q96SW2 13/20 0.39
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KLKB1 P03952 2/20 0.33
OPRK1 P41145 1/20 0.33
CNR2 P34972 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CHRM2 P08172 1/20 0.33
OPRM1 P35372 1/20 0.33
IKZF3 Q9UKT9 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL31068258 1.00 DDB1 (0.39) DDB1CRBNPDCD1CD274POLB
SCHEMBL29348643 0.89 CRBN (0.39) DDB1CRBNCNR2
SCHEMBL31068285 0.89 CRBN (0.39) DDB1CRBNCNR2
SCHEMBL29348388 0.87 DDB1 (0.43) DDB1CRBNPOLBNPSR1KLKB1
SCHEMBL29348430 0.87 DDB1 (0.43) DDB1CRBNPOLBNPSR1KLKB1
SCHEMBL31068226 0.87 DDB1 (0.43) DDB1CRBNPOLBNPSR1KLKB1
SCHEMBL31068322 0.87 DDB1 (0.43) DDB1CRBNPOLBNPSR1KLKB1
SCHEMBL29348758 0.87 DDB1 (0.43) DDB1CRBNPOLBNPSR1KLKB1
SCHEMBL31068339 0.84 DDB1 (0.37) DDB1CRBNPDCD1CD274KLKB1
SCHEMBL29348622 0.84 DDB1 (0.37) DDB1CRBNPDCD1CD274KLKB1

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