SCHEMBL24671187

SCHEMBL24671187

CC(C)(C)OC(=O)C1CCN(c2ccc(C(=O)NC3CCC(=O)NC3=O)nc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 19/20 0.49
DDB1 Q16531 10/20 0.47
IKZF3 Q9UKT9 1/20 0.40
BRD4 O60885 2/20 0.37
RIPK1 Q13546 1/20 0.37

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
SCHEMBL31055478 1.00 CRBN (0.49) CRBNDDB1IKZF3BRD4RIPK1
SCHEMBL24671245 0.92 CRBN (0.46) CRBNDDB1IKZF3
SCHEMBL30720114 0.88 CRBN (0.63) CRBNDDB1
SCHEMBL27238864 0.88 CRBN (0.63) CRBNDDB1
SCHEMBL27260521 0.88 CRBN (0.63) CRBNDDB1
SCHEMBL29579057 0.87 CRBN (0.58) CRBNDDB1
SCHEMBL24481327 0.87 CRBN (0.58) CRBNDDB1
SCHEMBL24671188 0.86 CRBN (0.55) CRBNDDB1IKZF3BRD4
SCHEMBL30066382 0.86 CRBN (0.55) CRBNDDB1IKZF3BRD4
SCHEMBL24421608 0.85 CRBN (0.56) CRBNDDB1IKZF3BRD4RIPK1

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
CN-117693502-A Compounds for inhibiting or degrading ITK, compositions comprising the same, methods of making the same, and methods of using the same 纽力克斯治疗公司 2024-03-12 CN disclosed
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 WO disclosed