SCHEMBL5507404

SCHEMBL5507404

[CH2]N1C(=O)CCC(N2C(=O)c3ccccc3C2=O)C1=O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 17/20 0.54
DDB1 Q16531 15/20 0.54
IKZF3 Q9UKT9 2/20 0.54
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
TNF P01375 1/20 0.42
IL1B P01584 1/20 0.42
TBXA2R P21731 1/20 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
SCHEMBL28704521 0.83 DDB1 (0.60) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL13364982 0.81 CRBN (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL845548 0.81 CRBN (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL13271120 0.81 CRBN (0.54) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL4108316 0.78 ALDH1A1 (0.51) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL4103132 0.77 DDB1 (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL11205141 0.77 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL21792468 0.77 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL2919642 0.77 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL10281158 0.77 CRBN (0.50) CRBNDDB1IKZF3ALDH1A1CHRM2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102370986-A Pharmaceutical compositions containing hydroxymethyl neurosedyn derivatives as well as preparation and application thereof TIANJIN HEMAY BIO TECH CO LTD 2012-03-14 CN claimed
CN-102370986-A Pharmaceutical compositions containing hydroxymethyl neurosedyn derivatives as well as preparation and application thereof TIANJIN HEMAY BIO TECH CO LTD 2012-03-14 CN disclosed
EP-1853302-A2 ANTIANGIOGENIC AGENTS WITH ALDESLEUKIN Novartis Vaccines and Diagnostics, Inc. (US) 2007-11-14 EP disclosed
WO-2006089150-A2 ANTIANGIOGENIC AGENTS WITH ALDESLEUKIN NOVARTIS VACCINES AND DIAGNOSTICS INC. (US) 2006-08-24 WO disclosed