SCHEMBL29644513

SCHEMBL29644513

[2H]C1c2ccccc2C([2H])N1C1CCC(=O)NC1=O

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 19/20 0.72
DDB1 Q16531 12/20 0.57
IKZF3 Q9UKT9 3/20 0.56
ALDH1A1 P00352 1/20 0.56
CHRM2 P08172 1/20 0.56
OPRM1 P35372 1/20 0.56
CYP1A2 P05177 1/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
TNF P01375 1/20 0.47
IL1B P01584 1/20 0.47
TBXA2R P21731 1/20 0.47
IKZF1 Q13422 1/20 0.47

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
SCHEMBL1499656 0.84 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29943635 0.84 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL6180704 0.84 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL6178113 0.84 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29923644 0.79 CRBN (0.83) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL19359391 0.79 CRBN (0.83) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL31129624 0.77 CRBN (0.49) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL23292786 0.75 CRBN (0.76) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL20812348 0.74 CRBN (0.67) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL20812483 0.73 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022119362-A1 GPX4 PROTEIN DEGRADATION-INDUCING COMPOUND (주) 업테라 2022-06-09 WO disclosed
WO-2022098108-A1 NLRP3 PROTEIN DEGRADATION INDUCING COMPOUND (주) 업테라 2022-05-12 WO disclosed