SCHEMBL29348758

SCHEMBL29348758

O=C1CC[C@H](c2cccc(-c3ccc(Cn4ccccc4=O)cc3)c2Cl)C(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 14/20 0.43
CRBN Q96SW2 14/20 0.43
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
IKZF3 Q9UKT9 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CHRM2 P08172 1/20 0.36
OPRM1 P35372 1/20 0.36
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KLKB1 P03952 1/20 0.35
IKZF2 Q9UKS7 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
SCHEMBL29348388 1.00 DDB1 (0.43) DDB1CRBNPOLBNPSR1IKZF3
SCHEMBL31068322 1.00 DDB1 (0.43) DDB1CRBNPOLBNPSR1IKZF3
SCHEMBL31068226 1.00 DDB1 (0.43) DDB1CRBNPOLBNPSR1IKZF3
SCHEMBL29348430 1.00 DDB1 (0.43) DDB1CRBNPOLBNPSR1IKZF3
SCHEMBL31068239 0.91 DDB1 (0.43) DDB1CRBNIKZF3ALDH1A1CHRM2
SCHEMBL29348409 0.90 DDB1 (0.41) DDB1CRBNIKZF3ALDH1A1CHRM2
SCHEMBL29348381 0.89 CRBN (0.42) DDB1CRBNIKZF3ALDH1A1CHRM2
SCHEMBL31068158 0.89 CRBN (0.47) DDB1CRBNIKZF3ALDH1A1CHRM2
SCHEMBL31068258 0.87 DDB1 (0.39) DDB1CRBNPOLBNPSR1IKZF3
SCHEMBL29348654 0.87 DDB1 (0.39) DDB1CRBNPOLBNPSR1IKZF3

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