SCHEMBL23768543

SCHEMBL23768543

O=C(O)CCOCCOCCOCCOCCOc1ccc2c(c1)C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 15/20 0.56
DDB1 Q16531 13/20 0.54
ALDH1A1 P00352 1/20 0.52
CHRM2 P08172 1/20 0.52
OPRM1 P35372 1/20 0.52
IKZF3 Q9UKT9 1/20 0.52
CYP1A2 P05177 1/20 0.52
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 1/20 0.51
LRRK2 Q5S007 1/20 0.48
IKZF2 Q9UKS7 1/20 0.48
BRD9 Q9H8M2 1/20 0.48

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
SCHEMBL29617107 1.00 CRBN (0.56) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24458684 1.00 CRBN (0.56) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL21471975 0.94 CRBN (0.54) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL31463319 0.94 CRBN (0.61) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29227672 0.94 CRBN (0.61) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30595247 0.91 CRBN (0.55) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29264031 0.91 CRBN (0.60) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20129105 0.90 CRBN (0.58) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30241737 0.90 CRBN (0.58) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29264013 0.89 CRBN (0.57) CRBNDDB1ALDH1A1CHRM2OPRM1

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-2021162493-A1 PROTEIN KINASE DEGRADATION INDUCING COMPOUND, AND USE THEREOF 보로노이 주식회사 2021-08-19 WO disclosed