SCHEMBL30859622

SCHEMBL30859622

CC(C)(C)OC(=O)n1cc(CCBr)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.65
HTR6 P50406 1/20 0.53
EPHX1 P07099 1/20 0.53
PDE10A Q9Y233 1/20 0.52
ADAM17 P78536 1/20 0.44
ACHE P22303 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PIM1 P11309 1/20 0.43
MARK3 P27448 1/20 0.43
MAP4K2 Q12851 1/20 0.43
CAMK2B Q13554 1/20 0.43
PIM3 Q86V86 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
BRD4 O60885 1/20 0.41
CREBBP Q92793 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
SCHEMBL4892277 1.00 L3MBTL1 (0.65) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL29504836 0.89 L3MBTL1 (0.67) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL1483546 0.89 L3MBTL1 (0.67) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL30721514 0.88 L3MBTL1 (0.66) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL22651784 0.88 L3MBTL1 (0.70) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL4109142 0.88 L3MBTL1 (0.66) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL12050578 0.87 L3MBTL1 (0.65) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL7505969 0.87 L3MBTL1 (0.65) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL29992401 0.87 L3MBTL1 (0.65) L3MBTL1HTR6EPHX1PDE10AADAM17
SCHEMBL10088115 0.86 L3MBTL1 (0.74) L3MBTL1HTR6EPHX1PDE10AADAM17

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-117486929-A Substituted alkyl germanium compound and modularized synthesis method thereof 西安交通大学 2024-02-02 CN claimed
CN-117486929-A Substituted alkyl germanium compound and modularized synthesis method thereof 西安交通大学 2024-02-02 CN disclosed