SCHEMBL2337176

SCHEMBL2337176

CC(=O)N(Cc1ccc2c(c1)CN(C1CCC(=O)NC1=O)C2=O)c1ccc(CCN2CCOCC2)c(Cl)c1.Cc1cc(CC(=O)NCc2ccc3c(c2)CN(C2CCC(=O)NC2=O)C3=O)ccc1CCN1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 13/20 0.52
GSPT1 P15170 12/20 0.52
DDB1 Q16531 2/20 0.52
IKZF3 Q9UKT9 1/20 0.52
CYP2C19 P33261 1/20 0.45
KCNH2 Q12809 1/20 0.45
TNF P01375 3/20 0.39
IKZF2 Q9UKS7 3/20 0.37
IKZF1 Q13422 1/20 0.36
IL1B P01584 1/20 0.36

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
SCHEMBL2337722 0.93 CRBN (0.54) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL2334587 0.92 CRBN (0.53) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL70103 0.89 CRBN (0.57) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL69198 0.89 CRBN (0.58) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL2342025 0.88 CRBN (0.54) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL70502 0.84 CRBN (0.59) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL70504 0.84 CRBN (0.57) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL69518 0.83 CRBN (0.58) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL69197 0.82 CRBN (0.61) CRBNGSPT1DDB1IKZF3CYP2C19
SCHEMBL70102 0.81 CRBN (0.56) CRBNGSPT1DDB1IKZF3CYP2C19

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-2358697-A1 Isoindoline compounds for use in the treatment of cancer CELGENE CORPORATION (US) 2011-08-24 EP disclosed
WO-2010053732-A1 ISOINDOLINE COMPOUNDS FOR USE IN THE TREATMENT OF CANCER CELGENE CORPORATION (US) 2010-05-14 WO disclosed