SCHEMBL28299867

SCHEMBL28299867

O=c1cc[nH]c(=O)n1CCBr

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
BRD4 O60885 1/20 0.32
TAF1 P21675 1/20 0.32
BRPF1 P55201 1/20 0.32
CREBBP Q92793 1/20 0.32
CECR2 Q9BXF3 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
TYMP P19971 1/20 0.31
BCHE P06276 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL4348692 0.87 ADRA1D (0.37) ADRA1DADRA1AADRA1BBRD4TAF1
SCHEMBL10981137 0.85 TYMP (0.39) ADRA1DADRA1AADRA1BTYMP
SCHEMBL7181586 0.85 TYMP (0.39) ADRA1DADRA1AADRA1BTYMP
SCHEMBL8377767 0.83 ADRA1D (0.31) ADRA1DADRA1AADRA1B
SCHEMBL9118472 0.80 KDM4E (0.39)
SCHEMBL2983409 0.80 ADRA1D (0.34) ADRA1DADRA1AADRA1BBRD4TAF1
SCHEMBL10428820 0.80 ADRA1D (0.34) ADRA1DADRA1AADRA1BBRD4TAF1
SCHEMBL3235865 0.80 ADRA1D (0.37) ADRA1DADRA1AADRA1BBRD4TAF1
SCHEMBL2930015 0.80 HASPIN (0.35) ADRA1DADRA1AADRA1BBRD4TAF1
SCHEMBL17371770 0.77 HASPIN (0.43) ADRA1DADRA1AADRA1BTYMP

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-101253199-B Agonists, antagonists and immunotoxins for immunomodulating tumor necrosis factor receptor 25(TNFR25) 迈阿密大学 2019-06-14 CN disclosed