SCHEMBL6318979

SCHEMBL6318979

CCN(C(C(=O)c1ccccc1)c1ccccc1)S(=O)(=O)c1ccc2cc(Br)ccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
C5AR1 P21730 1/20 0.38
HSP90AA1 P07900 2/20 0.37
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MMP2 P08253 2/20 0.36
MMP13 P45452 2/20 0.36
CNR2 P34972 1/20 0.36
F10 P00742 2/20 0.36
ALDH1A1 P00352 2/20 0.36
BMP1 P13497 1/20 0.36
KAT6A Q92794 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PGR P06401 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
HTR2A P28223 1/20 0.36

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
SCHEMBL5899428 0.77 PGR (0.50) MEN1KMT2AMMP2MMP13CNR2
SCHEMBL5899470 0.74 PGR (0.52) C5AR1MMP2BMP1PGRADRA2A
SCHEMBL5899478 0.67 PGR (0.59) MEN1KMT2ALMNAL3MBTL1MMP2
SCHEMBL5899453 0.66 PGR (0.51) MEN1KMT2AHSP90AA1LMNAMMP2
SCHEMBL5899600 0.65 PGR (0.54) LMNAMMP2MMP13SMN1; SMN2PGR
SCHEMBL5899623 0.65 PGR (0.54) CNR2ALDH1A1PGRADRA2AADRA2B
SCHEMBL3881897 0.65 MAPT (0.51) MEN1KMT2ALMNAL3MBTL1F10
SCHEMBL28245581 0.65 CYP2A6 (0.44) MEN1KMT2ALMNAL3MBTL1MMP2
SCHEMBL5899459 0.65 PGR (0.52) MEN1KMT2ALMNAL3MBTL1CNR2
SCHEMBL5899424 0.65 PGR (0.52) MEN1KMT2ALMNAL3MBTL1MMP2

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
US-20050272036-A1 Ketones ASTRAZENECA AB (SE) 2005-12-08 US disclosed