SCHEMBL29360415

SCHEMBL29360415

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)OCN1C(=O)CCC(N2C(=O)c3cccc(F)c3C2=O)C1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 6/20 0.44
CRBN Q96SW2 6/20 0.44
SCN9A Q15858 8/20 0.37
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
STAT3 P40763 1/20 0.34
TRPA1 O75762 1/20 0.33

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
SCHEMBL22143891 0.91 DDB1 (0.45) DDB1CRBNCYP3A4CYP2D6CYP2C9
SCHEMBL7742010 0.90 DDB1 (0.43) DDB1CRBNSCN9ACYP3A4CYP2D6
SCHEMBL22143936 0.85 DDB1 (0.44) DDB1CRBNSTAT3
SCHEMBL22144163 0.85 CYP3A4 (0.44) DDB1CRBNCYP3A4CYP2D6CYP2C9
SCHEMBL14142265 0.82 DDB1 (0.42) DDB1CRBNSCN9ACYP3A4CYP2D6
SCHEMBL14294652 0.82 DDB1 (0.42) DDB1CRBNSCN9ACYP3A4CYP2D6
SCHEMBL24421051 0.81 DDB1 (0.47) DDB1CRBNADRA1DADRA1AADRA1B
SCHEMBL29614631 0.81 DDB1 (0.47) DDB1CRBNADRA1DADRA1AADRA1B
SCHEMBL22144164 0.81 DDB1 (0.42) DDB1CRBNSCN9ASTAT3
SCHEMBL14294761 0.80 DDB1 (0.43) DDB1CRBNADRA1DADRA1AADRA1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114341128-B Bifunctional protein degradation targeting chimeric compound, preparation method and medical application thereof 恩瑞生物医药科技(上海)有限公司 2024-06-25 CN disclosed
CN-114341128-A Bifunctional protein degradation targeting chimera compound and preparation method and medical application thereof 恩瑞生物医药科技(上海)有限公司 2022-04-12 CN disclosed
WO-2022017442-A1 BIFUNCTIONAL PROTEIN DEGRADATION-TARGETED CHIMERA COMPOUND, PREPARATION METHOD THEREFOR AND MEDICINAL USE THEREOF 恩瑞生物医药科技(上海)有限公司 2022-01-27 WO disclosed