SCHEMBL22609574

SCHEMBL22609574

[CH2]CCCCc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 19/20 0.63
CRBN Q96SW2 19/20 0.63
IKZF3 Q9UKT9 2/20 0.63
TNF P01375 1/20 0.63
IL1B P01584 1/20 0.63
TBXA2R P21731 1/20 0.63
IKZF1 Q13422 1/20 0.63
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
SCHEMBL26317539 0.93 DDB1 (0.68) DDB1CRBNIKZF3TNFIL1B
SCHEMBL21070727 0.93 CRBN (0.61) DDB1CRBNIKZF3TNFIL1B
SCHEMBL22533174 0.89 DDB1 (0.65) DDB1CRBNIKZF3TNFIL1B
SCHEMBL22443118 0.88 DDB1 (0.65) DDB1CRBNIKZF3TNFIL1B
SCHEMBL21071227 0.88 DDB1 (0.64) DDB1CRBNIKZF3TNFIL1B
SCHEMBL23169017 0.88 DDB1 (0.64) DDB1CRBNIKZF3TNFIL1B
SCHEMBL21070618 0.88 DDB1 (0.65) DDB1CRBNIKZF3TNFIL1B
SCHEMBL22636788 0.88 DDB1 (0.65) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31411864 0.88 DDB1 (0.61) DDB1CRBNIKZF3TNFIL1B
SCHEMBL31622230 0.88 DDB1 (0.64) 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
EP-3731869-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2020-11-04 EP disclosed