SCHEMBL27257521

SCHEMBL27257521

CC(C)(C)OC(=O)n1cc(-c2cccc(-c3ccccc3)c2)c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
BRD4 O60885 2/20 0.49
CREBBP Q92793 1/20 0.49
PIM1 P11309 1/20 0.49
MARK3 P27448 1/20 0.49
MAP4K2 Q12851 1/20 0.49
CAMK2B Q13554 1/20 0.49
PIM3 Q86V86 1/20 0.49
PIM2 Q9P1W9 1/20 0.49
ACHE P22303 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PDE10A Q9Y233 1/20 0.44
EPHX1 P07099 1/20 0.44
HTR6 P50406 2/20 0.43
HTT P42858 1/20 0.42
ADAM17 P78536 1/20 0.41
ACLY P53396 1/20 0.40
USP30 Q70CQ3 2/20 0.40
NR1H2 P55055 1/20 0.39

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
SCHEMBL30620463 0.82 L3MBTL1 (0.50) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL23496956 0.82 L3MBTL1 (0.53) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL30719630 0.82 L3MBTL1 (0.53) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL5871186 0.81 L3MBTL1 (0.51) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL31070592 0.79 L3MBTL1 (0.47) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL29831138 0.79 L3MBTL1 (0.47) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL23330849 0.79 L3MBTL1 (0.47) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL121876 0.78 SCN9A (0.43) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL22468928 0.78 KMT2A (0.49) L3MBTL1BRD4CREBBPPIM1MARK3
SCHEMBL24721683 0.78 L3MBTL1 (0.46) L3MBTL1BRD4CREBBPPIM1MARK3

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-1024797-C Indole derivatives OTSUKA CHEMICAL CO LTD (JP) 1994-06-01 CN disclosed
CN-1049155-A INDOLE DERIVATIVES OTSUKA CHEMICAL CO LTD (JP) 1991-02-13 CN disclosed