SCHEMBL5324032

SCHEMBL5324032

CC(C)(C)OC(=O)NCCN1CCN(CCO)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.57
CACNA1H O95180 1/20 0.56
TDP1 Q9NUW8 1/20 0.54
SIGMAR1 Q99720 3/20 0.47
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GFER P55789 1/20 0.44
CD274 Q9NZQ7 1/20 0.44

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
SCHEMBL31301242 0.93 DRD2 (0.63) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL30380480 0.91 TDP1 (0.59) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL13202614 0.89 DRD2 (0.59) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL18390128 0.87 DRD2 (0.57) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL24172673 0.87 DRD2 (0.56) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL4024516 0.87 DRD2 (0.56) DRD2CACNA1HTDP1MEN1GAA
SCHEMBL31301250 0.87 DRD2 (0.56) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL13075277 0.86 DRD2 (0.56) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL31496727 0.86 DRD2 (0.56) DRD2CACNA1HTDP1SIGMAR1MEN1
SCHEMBL485945 0.85 DRD2 (0.55) DRD2CACNA1HTDP1MEN1KMT2A

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 4 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
WO-2007102679-A1 NOVEL THIENOPYRIMIDINE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME JE IL PHARMACEUTICAL CO., LTD. (KR) 2007-09-13 WO disclosed