SCHEMBL28601684

SCHEMBL28601684

NC(=O)C1CCC(C(=O)Nc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)CC1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 16/20 0.71
CRBN Q96SW2 16/20 0.71
IKZF3 Q9UKT9 2/20 0.60
TNF P01375 1/20 0.60
IL1B P01584 1/20 0.60
TBXA2R P21731 1/20 0.60
IKZF1 Q13422 1/20 0.60
HDAC1 Q13547 2/20 0.56
HDAC2 Q92769 2/20 0.56
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
STAT3 P40763 1/20 0.52
HDAC3 O15379 1/20 0.51
NCOR2 Q9Y618 1/20 0.51

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
SCHEMBL26318031 0.95 DDB1 (0.78) DDB1CRBNIKZF3TNFIL1B
SCHEMBL26318034 0.95 DDB1 (0.78) DDB1CRBNIKZF3TNFIL1B
SCHEMBL26321362 0.95 DDB1 (0.78) DDB1CRBNIKZF3TNFIL1B
SCHEMBL2382531 0.95 DDB1 (0.78) DDB1CRBNIKZF3TNFIL1B
SCHEMBL29794467 0.95 DDB1 (0.78) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31292080 0.88 DDB1 (0.66) DDB1CRBNIKZF3TNFIL1B
SCHEMBL26317715 0.86 CRBN (0.66) DDB1CRBNIKZF3TNFIL1B
SCHEMBL23751736 0.85 DDB1 (0.76) DDB1CRBNIKZF3TNFIL1B
SCHEMBL16569284 0.84 DDB1 (0.82) DDB1CRBNIKZF3TNFIL1B
SCHEMBL18546682 0.84 DDB1 (0.82) DDB1CRBNIKZF3TNFIL1B

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
CN-112512589-A Dimeric immunomodulatory compounds against CEREBLON-based mechanisms H·李·莫菲特癌症中心研究有限公司 2021-03-16 CN disclosed