SCHEMBL18315169

SCHEMBL18315169

O=C1CCC(N2C(=O)c3ccccc3C2OCc2ccc(CN3CCN(S(=O)(=O)CC(F)(F)F)CC3)cc2)C(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.45
▸ IKZF3 Q9UKT9 18/20 0.45
▸ DDB1 Q16531 4/20 0.45
▸ TNF P01375 3/20 0.42
▸ IL1B P01584 3/20 0.42
▸ IKZF1 Q13422 1/20 0.42

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
SCHEMBL25124004 0.79 CRBN (0.53) CRBNIKZF3DDB1TNFIL1B
SCHEMBL2252005 0.78 CRBN (0.75) CRBNIKZF3DDB1TNFIL1B
SCHEMBL30493802 0.78 CRBN (0.75) CRBNIKZF3DDB1TNFIL1B
SCHEMBL25219152 0.76 CRBN (0.66) CRBNIKZF3DDB1
SCHEMBL22549814 0.74 CRBN (0.44) CRBNIKZF3DDB1
SCHEMBL22549815 0.74 CRBN (0.44) CRBNIKZF3DDB1
SCHEMBL22533105 0.74 CRBN (0.44) CRBNIKZF3DDB1
SCHEMBL2250459 0.70 CRBN (0.73) CRBNIKZF3DDB1TNFIL1B
SCHEMBL22564890 0.69 CRBN (0.59) CRBNIKZF3DDB1TNFIL1B
SCHEMBL23565388 0.69 CRBN (0.59) CRBNIKZF3DDB1TNFIL1B

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-3106460-A1 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2016-12-21 — — EP disclosed
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