SCHEMBL30417838

SCHEMBL30417838

COC(=O)c1ccc(-c2cn(Cc3cccnn3)c3cc(-c4c(C)noc4C)cnc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 16/20 0.51
GRIN2B Q13224 2/20 0.44
ATAD2 Q6PL18 1/20 0.38
BRD2 P25440 1/20 0.37

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
SCHEMBL16697508 1.00 BRD4 (0.51) BRD4GRIN2BATAD2BRD2
SCHEMBL16696893 0.91 BRD4 (0.60) BRD4GRIN2BBRD2
SCHEMBL16697948 0.91 BRD4 (0.57) BRD4ATAD2BRD2
SCHEMBL16697023 0.88 BRD4 (0.51) BRD4ATAD2BRD2
SCHEMBL16697112 0.88 BRD4 (0.51) BRD4ATAD2BRD2
SCHEMBL19183635 0.86 BRD4 (0.53) BRD4ATAD2
SCHEMBL16697558 0.86 BRD4 (0.61) BRD4ATAD2
SCHEMBL16697008 0.85 BRD4 (0.60) BRD4ATAD2
SCHEMBL16696830 0.85 BRD4 (0.51) BRD4GRIN2BATAD2BRD2
SCHEMBL16696825 0.85 BRD4 (0.51) BRD4ATAD2

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
WO-2023213801-A1 PRE-TARGETING PRECIRIX N.V. (BE) 2023-11-09 WO disclosed
EP-4178982-A1 ANTIBODY FRAGMENT AGAINST FOLR1 Precirix N.V. (BE) 2023-05-17 EP disclosed