SCHEMBL4667779

SCHEMBL4667779

NS(=O)(=O)Oc1ccc(-c2ccccc2)cc1Br

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.56
CA9 Q16790 12/20 0.56
CA1 P00915 11/20 0.56
CA12 O43570 5/20 0.47
STS P08842 3/20 0.43
CYP19A1 P11511 2/20 0.43
WDR5 P61964 1/20 0.40
MEN1 O00255 1/20 0.40
APAF1 O14727 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
XBP1 P17861 1/20 0.40
PTBP1 P26599 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
GALK1 P51570 1/20 0.40
BLM P54132 1/20 0.40
SMAD3 P84022 1/20 0.40

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
SCHEMBL4667168 0.80 CA2 (0.56) CA2CA9CA1CA12STS
SCHEMBL4667783 0.80 CA1 (0.56) CA2CA9CA1CA12STS
SCHEMBL3379931 0.76 CA2 (0.50) CA2CA9CA1CA12STS
SCHEMBL3924409 0.73 MAPT (0.57) NPC1LMNAMAPTTHRBRAB9A
SCHEMBL7785330 0.72 EPAS1 (0.39) CA2CA1
SCHEMBL7263619 0.72 CA2 (1.00) CA2CA9CA1CA12STS
Water SCHEMBL8845490 0.72 MAPT (0.56) NPC1LMNAMAPTTHRBRAB9A
SCHEMBL9451359 0.72 CA2 (0.70) CA2CA9CA1CA12STS
SCHEMBL2591595 0.70 CA2 (0.68) CA2CA9CA1CA12STS
SCHEMBL10864194 0.70 PKM (0.58) CA2CA9CA1CA12WDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1193250-B1 PHENYL SULFAMATE DERIVATIVES TEIKOKU HORMONE MFG CO LTD (JP) 2008-06-04 EP disclosed
US-6762205-B1 STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION TEIKOKU HORMONE MFG. CO., LTD. (JP) 2004-07-13 US disclosed
EP-1193250-A1 PHENYL SULFAMATE DERIVATIVES Teikoku Hormone Mfg. Co., Ltd. (JP) 2002-04-03 EP disclosed