SCHEMBL24671242

SCHEMBL24671242

O=C1CCC(NC(=O)c2ccc(N3CCC(O)CC3)cn2)C(=O)N1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 18/20 0.57
DDB1 Q16531 5/20 0.48
IKZF3 Q9UKT9 1/20 0.46
BRD4 O60885 2/20 0.42
ABL1 P00519 1/20 0.41
PARP1 P09874 1/20 0.41

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
SCHEMBL24421608 0.91 CRBN (0.56) CRBNDDB1IKZF3BRD4PARP1
SCHEMBL24671244 0.90 CRBN (0.58) CRBNDDB1IKZF3BRD4PARP1
SCHEMBL30801203 0.90 CRBN (0.58) CRBNDDB1IKZF3BRD4PARP1
SCHEMBL30066382 0.90 CRBN (0.55) CRBNDDB1IKZF3BRD4PARP1
SCHEMBL24421607 0.90 CRBN (0.55) CRBNDDB1IKZF3BRD4PARP1
SCHEMBL24671188 0.90 CRBN (0.55) CRBNDDB1IKZF3BRD4PARP1
SCHEMBL30903885 0.89 CRBN (0.57) CRBNDDB1IKZF3BRD4ABL1
SCHEMBL27238859 0.89 CRBN (0.57) CRBNDDB1IKZF3BRD4ABL1
SCHEMBL31756551 0.89 CRBN (0.57) CRBNDDB1IKZF3BRD4ABL1
SCHEMBL20436991 0.89 CRBN (0.57) CRBNDDB1IKZF3BRD4ABL1

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-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