SCHEMBL30805459

SCHEMBL30805459

CC(C)(C)OC(=O)NCCCCCCCc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 16/20 0.72
DDB1 Q16531 15/20 0.72
STAT3 P40763 3/20 0.52
GRAMD1A Q96CP6 1/20 0.50
TNF P01375 1/20 0.49
IL1B P01584 1/20 0.49
TBXA2R P21731 1/20 0.49
IKZF1 Q13422 1/20 0.49
IKZF3 Q9UKT9 1/20 0.49
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
NCOR2 Q9Y618 1/20 0.48

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
SCHEMBL24620977 1.00 CRBN (0.72) CRBNDDB1STAT3GRAMD1ATNF
SCHEMBL31307125 1.00 CRBN (0.72) CRBNDDB1STAT3GRAMD1ATNF
SCHEMBL23842551 1.00 CRBN (0.72) CRBNDDB1STAT3GRAMD1ATNF
SCHEMBL21071278 0.97 CRBN (0.74) CRBNDDB1STAT3TNFIL1B
SCHEMBL21069931 0.96 CRBN (0.69) CRBNDDB1STAT3GRAMD1ATNF
SCHEMBL21070004 0.95 CRBN (0.68) CRBNDDB1STAT3GRAMD1A
SCHEMBL21227737 0.93 DDB1 (0.77) CRBNDDB1STAT3TNFIL1B
SCHEMBL21071039 0.92 CRBN (0.70) CRBNDDB1STAT3GRAMD1A
SCHEMBL21070933 0.91 CRBN (0.69) CRBNDDB1STAT3GRAMD1A
SCHEMBL21070296 0.91 CRBN (0.69) CRBNDDB1STAT3GRAMD1A

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-2024054625-A2 BIFUNCTIONAL COMPOUNDS FOR DEGRADING KRAS G12D VIA UBIQUITIN PROTEASOME PATHWAY NIKANG THERAPEUTICS, INC. (US) 2024-03-14 WO disclosed