SCHEMBL29348653

SCHEMBL29348653

O=C1CCC(c2cccc(-c3ccc(N4CCN(CC(F)F)CC4=O)cc3)c2Cl)C(=O)N1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 15/20 0.36
DDB1 Q16531 11/20 0.36
IKZF3 Q9UKT9 7/20 0.35
P2RX7 Q99572 2/20 0.33
IKZF2 Q9UKS7 1/20 0.33
TNF P01375 1/20 0.32
IL1B P01584 1/20 0.32
TBXA2R P21731 1/20 0.32
IKZF1 Q13422 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CHRM2 P08172 1/20 0.32
OPRM1 P35372 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
FNTA P49354 1/20 0.32
PGGT1B P53609 1/20 0.32

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
SCHEMBL31068216 1.00 CRBN (0.36) CRBNDDB1IKZF3P2RX7IKZF2
SCHEMBL31068143 0.88 CRBN (0.35) CRBNDDB1IKZF3P2RX7IKZF2
SCHEMBL29348984 0.88 CRBN (0.35) CRBNDDB1IKZF3P2RX7IKZF2
SCHEMBL29348551 0.84 CRBN (0.43) CRBNDDB1IKZF3
SCHEMBL29348394 0.83 DDB1 (0.43) CRBNDDB1IKZF3TNFIL1B
SCHEMBL29348987 0.83 P2RX7 (0.34) P2RX7FNTAPGGT1B
SCHEMBL29348959 0.83 CRBN (0.35) CRBNDDB1IKZF3TNFIL1B
SCHEMBL31068221 0.83 CRBN (0.35) CRBNDDB1IKZF3TNFIL1B
SCHEMBL29348393 0.81 CNR2 (0.42) CRBNDDB1IKZF3TNFIL1B
SCHEMBL29348285 0.81 DDB1 (0.41) CRBNDDB1IKZF3TNFIL1B

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