SCHEMBL19370784

SCHEMBL19370784

C=C1c2c(C)cccc2C(=O)N1C1CCC(=O)N(C(C)C)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 12/20 0.46
CRBN Q96SW2 12/20 0.46
IKZF3 Q9UKT9 2/20 0.37
TNF P01375 1/20 0.37
IL1B P01584 1/20 0.37
TBXA2R P21731 1/20 0.37
IKZF1 Q13422 1/20 0.37
ALDH1A1 P00352 2/20 0.33
CHRM2 P08172 1/20 0.33
OPRM1 P35372 1/20 0.33
DPP4 P27487 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTR2B P41595 2/20 0.32
TMEM97 Q5BJF2 2/20 0.32
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL19370783 0.87 DDB1 (0.47) DDB1CRBNIKZF3TNFIL1B
SCHEMBL19370936 0.85 CRBN (0.49) DDB1CRBNIKZF3TNFIL1B
SCHEMBL10281239 0.82 DDB1 (0.56) DDB1CRBNIKZF3TNFIL1B
SCHEMBL10281158 0.80 CRBN (0.50) DDB1CRBNIKZF3TNFIL1B
SCHEMBL19359312 0.76 DDB1 (0.60) DDB1CRBNIKZF3TNFIL1B
SCHEMBL19250991 0.75 DDB1 (0.80) DDB1CRBNIKZF3TNFIL1B
SCHEMBL22940384 0.73 CRBN (0.62) DDB1CRBNIKZF3TNFIL1B
SCHEMBL3797637 0.72 DDB1 (0.60) DDB1CRBNIKZF3TNFIL1B
SCHEMBL25834823 0.69 CRBN (0.58) DDB1CRBNIKZF3TNFIL1B
SCHEMBL19359347 0.69 DDB1 (0.54) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017161119-A1 SMALL MOLECULES AGAINST CEREBLON TO ENHANCE EFFECTOR T CELL FUNCTION H. LEE MOFFITT CANCER CENTER & RESEARCH INSTITUTE, INC. (US) 2017-09-21 WO disclosed