SCHEMBL13716888

SCHEMBL13716888

O=C1CCC(N2C(=O)c3cccc(NC(=O)CCCCCCNC(=O)OCc4ccccc4)c3C2=O)C(=O)N1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 11/20 0.58
HDAC3 O15379 8/20 0.58
HDAC2 Q92769 8/20 0.58
NCOR2 Q9Y618 8/20 0.58
CRBN Q96SW2 4/20 0.57
DDB1 Q16531 3/20 0.57
HDAC6 Q9UBN7 4/20 0.57
HDAC4 P56524 1/20 0.57
STAT3 P40763 1/20 0.54
HDAC8 Q9BY41 1/20 0.53
MIF P14174 4/20 0.53

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
SCHEMBL2382454 1.00 HDAC1 (0.58) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL30050518 0.91 CRBN (0.66) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL30049440 0.91 CRBN (0.66) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL23884287 0.89 CRBN (0.65) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL2383505 0.88 DDB1 (0.70) HDAC1HDAC2CRBNDDB1STAT3
SCHEMBL26317743 0.87 DDB1 (0.74) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL26323698 0.87 DDB1 (0.74) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL26317747 0.87 DDB1 (0.74) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL26317745 0.87 DDB1 (0.74) HDAC1HDAC3HDAC2NCOR2CRBN
SCHEMBL22276611 0.87 CRBN (0.75) HDAC1HDAC3HDAC2NCOR2CRBN

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
US-7576104-B2 Isoindole-imide compounds, compositions, and uses thereof CELGENE CORPORATION (US) 2009-08-18 US disclosed
US-7576104-B2 Isoindole-imide compounds, compositions, and uses thereof CELGENE CORPORATION (US) 2009-08-18 US disclosed