SCHEMBL25809353

SCHEMBL25809353

CCOC(=O)c1cc2c(-c3cc(C(C)(C)O)ccc3Oc3c(C)cc(F)cc3C)cn(C)c(=O)c2[nH]1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.81
BRD2 P25440 1/20 0.80
KCNH2 Q12809 1/20 0.80
BRD3 Q15059 1/20 0.80
BRDT Q58F21 1/20 0.80
HDAC1 Q13547 2/20 0.70
HDAC6 Q9UBN7 2/20 0.70
HDAC3 O15379 1/20 0.68
HDAC11 Q96DB2 1/20 0.68
HDAC8 Q9BY41 1/20 0.68

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
SCHEMBL29623578 0.94 BRD4 (0.70) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL22443010 0.94 BRD4 (0.70) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL19464042 0.90 BRD4 (0.86) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL19463886 0.89 BRD4 (1.00) BRD4BRD2KCNH2BRD3BRDT
Abbv-744 SCHEMBL19463409 0.89 BRD4 (1.00) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL30693825 0.88 BRD4 (0.77) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL19463232 0.88 BRD4 (1.00) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL21652829 0.88 BRD4 (0.74) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL19463119 0.87 BRD4 (1.00) BRD4BRD2KCNH2BRD3BRDT
SCHEMBL21652758 0.87 BRD4 (0.62) BRD4BRD2KCNH2BRD3BRDT

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
EP-4460302-A2 COMPOUNDS AND METHODS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2024-11-13 EP disclosed
EP-4274583-A2 METHODS AND COMPOUNDS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2023-11-15 EP disclosed
WO-2023133284-A2 COMPOUNDS AND METHODS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2023-07-13 WO disclosed
WO-2023133284-A2 COMPOUNDS AND METHODS FOR TREATING FRIEDREICH'S ATAXIA Design Therapeutics, Inc. (US) 2023-07-13 WO disclosed