SCHEMBL31073198

SCHEMBL31073198

CC(C)(C)OC(=O)N1CC=C(c2ccn3c(=O)n(C4CCC(=O)NC4=O)nc3c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 10/20 0.43
▸ CRBN Q96SW2 10/20 0.43
▸ CDK7 P50613 1/20 0.41
▸ CDK13 Q14004 1/20 0.41
▸ CDK12 Q9NYV4 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ PDK4 Q16654 1/20 0.40
▸ NAMPT P43490 1/20 0.39
▸ TNK2 Q07912 1/20 0.38
▸ GRM1 Q13255 4/20 0.38
▸ GRM5 P41594 3/20 0.38

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
SCHEMBL22006726 0.82 DDB1 (0.54) DDB1CRBNNAMPT
SCHEMBL20234368 0.82 DDB1 (0.51) DDB1CRBN
SCHEMBL25036448 0.81 CDK7 (0.45) DDB1CRBNCDK7CDK13CDK12
SCHEMBL31073337 0.80 DDB1 (0.42) DDB1CRBNNAMPT
SCHEMBL30493301 0.79 CRBN (0.49) DDB1CRBN
SCHEMBL31073284 0.78 JAK1 (0.45) DDB1CRBNCDK7CDK13CDK12
SCHEMBL20046320 0.78 CRBN (0.54) DDB1CRBNJAK1BRD4PDK4
SCHEMBL29367280 0.78 CRBN (0.54) DDB1CRBNJAK1BRD4PDK4
SCHEMBL30274113 0.78 CDK7 (0.43) DDB1CRBNCDK7CDK13CDK12
SCHEMBL25224393 0.77 NAMPT (0.46) DDB1CRBNCDK7CDK13CDK12

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-2024173646-A1 CYCLIN-DEPENDENT KINASE DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. (US) 2024-08-22 — — WO disclosed
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