SCHEMBL7185963

SCHEMBL7185963

NCc1cccc(-c2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)c1Cl

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 19/20 0.66
CRBN Q96SW2 19/20 0.66
IKZF3 Q9UKT9 2/20 0.66
TNF P01375 1/20 0.66
IL1B P01584 1/20 0.66
TBXA2R P21731 1/20 0.66
IKZF1 Q13422 1/20 0.66
ALDH1A1 P00352 1/20 0.60
CHRM2 P08172 1/20 0.60
OPRM1 P35372 1/20 0.60
CYP1A2 P05177 1/20 0.60
TSHR P16473 1/20 0.60
TDP1 Q9NUW8 1/20 0.60

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
SCHEMBL476975 0.90 DDB1 (0.73) DDB1CRBNIKZF3TNFIL1B
SCHEMBL29922269 0.90 DDB1 (0.73) DDB1CRBNIKZF3TNFIL1B
SCHEMBL5635300 0.90 DDB1 (0.73) DDB1CRBNIKZF3TNFIL1B
Hydrochloric Acid SCHEMBL29377763 0.89 DDB1 (0.72) DDB1CRBNIKZF3TNFIL1B
Hydrochloric Acid SCHEMBL1961858 0.89 DDB1 (0.72) DDB1CRBNIKZF3TNFIL1B
SCHEMBL21227696 0.83 DDB1 (0.70) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25270736 0.83 CRBN (0.70) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31076948 0.83 CRBN (0.70) DDB1CRBNIKZF3TNFIL1B
SCHEMBL2053211 0.82 DDB1 (0.73) DDB1CRBNIKZF3TNFIL1B
SCHEMBL22787058 0.82 CRBN (0.71) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363900-A1 ISOINDOLE-IMIDE COMPOUNDS AS TNF-INHIBITORS CELGENE CORPORATION (US) 2003-11-26 EP claimed
WO-2002059106-A1 ISOINDOLE-IMIDE COMPOUNDS, COMPOSITIONS, AND USES THEREOF CELGENE CORPORATION (US) 2002-08-01 WO claimed