SCHEMBL4290486

SCHEMBL4290486

CS(=O)(=O)N(Cc1ccccc1)c1cc(CC(O)Br)ccc1OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.45
PTPN2 P17706 2/20 0.45
PTPN6 P29350 2/20 0.45
CYP19A1 P11511 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PTPRF P10586 1/20 0.43
PTPN11 Q06124 1/20 0.43
ALDH1A1 P00352 3/20 0.42
FOLH1 Q04609 1/20 0.39
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACLY P53396 1/20 0.39
CCR5 P51681 1/20 0.39

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
SCHEMBL3292376 0.83 CYP19A1 (0.48) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL964882 0.83 L3MBTL1 (0.44) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL964883 0.83 L3MBTL1 (0.44) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL7536141 0.81 L3MBTL1 (0.44) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL7532766 0.81 L3MBTL1 (0.44) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL963777 0.80 MEN1 (0.52) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL964676 0.79 NPC1 (0.46) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL7618225 0.78 L3MBTL1 (0.40) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL3286888 0.78 ALDH1A1 (0.48) PTPN1PTPN2PTPN6CYP19A1L3MBTL1
SCHEMBL7528094 0.77 NPC1 (0.46) PTPN1PTPN2PTPN6CYP19A1L3MBTL1

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
EP-2035004-A1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY Parion Sciences, Inc. (US) 2009-03-18 EP disclosed
WO-2007146869-A1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY PARION SCIENCES, INC. (US) 2007-12-21 WO disclosed