SCHEMBL28291525

SCHEMBL28291525

CS(=O)(=O)c1ccc(N2CC(=O)NC2=O)cc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 11/20 0.42
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
PTGS2 P35354 1/20 0.34
PIK3CD O00329 2/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
BRD4 O60885 1/20 0.33
ABCB11 O95342 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ADRA1A P35348 1/20 0.32

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
SCHEMBL16879321 0.74 AR (0.65) ARPKMRAB9AMEN1KMT2A
SCHEMBL1191623 0.73 AR (0.68) ARRAB9AMEN1KMT2A
SCHEMBL28291524 0.73 AR (0.39) ARMEN1KMT2A
SCHEMBL28118768 0.72 AR (0.41) ARPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL28872810 0.71 HTR6 (0.42) PKMRAB9A
SCHEMBL27350499 0.70 DDB1 (0.42) PTGS2MEN1KMT2A
SCHEMBL19410379 0.69 LMNA (0.51) PTGS2
SCHEMBL29872795 0.69 MEN1 (0.61) ARRAB9AMEN1KMT2A
SCHEMBL25316229 0.69 PIK3CD (0.43) ARPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL4639494 0.69 L3MBTL1 (0.56) ARPIK3CDPIK3CAPIK3CBPIK3CG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106573921-B Imidazolidine-2, 4-dione derivatives 博福-益普生(天津)制药有限公司 2019-05-07 CN disclosed