SCHEMBL29549346

SCHEMBL29549346

O=C(O)COc1cc2c3c(cccc3c1)C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.66
▸ DDB1 Q16531 17/20 0.66
▸ IKZF3 Q9UKT9 3/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ CHRM2 P08172 1/20 0.54
▸ OPRM1 P35372 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ TNF P01375 1/20 0.49
▸ IL1B P01584 1/20 0.49
▸ TBXA2R P21731 1/20 0.49
▸ IKZF1 Q13422 1/20 0.49

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
SCHEMBL22532028 1.00 CRBN (0.66) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22531990 0.88 DDB1 (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29388131 0.88 DDB1 (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22845547 0.88 CRBN (0.63) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22532036 0.87 CRBN (0.53) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29549308 0.87 CRBN (0.53) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL21814681 0.86 CRBN (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29658960 0.86 CRBN (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL27385021 0.85 CRBN (0.60) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL24489953 0.85 CRBN (0.54) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3953337-A1 DEGRADERS OF KELCH-LIKE ECH-ASSOCIATED PROTEIN 1 (KEAP1) Dana-Farber Cancer Institute, Inc. (US) 2022-02-16 — — EP disclosed
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