SCHEMBL7090901

SCHEMBL7090901

Cc1ccccc1Oc1ccccc1S(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 3/20 0.52
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
TSHR P16473 1/20 0.44
RAB9A P51151 1/20 0.44
MYC P01106 1/20 0.43
HPGD P15428 1/20 0.43
TBXA2R P21731 7/20 0.42
ESR1 P03372 1/20 0.42
GAA P10253 1/20 0.42
ESR2 Q92731 1/20 0.42
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAPGEF4 Q8WZA2 1/20 0.38
POLB P06746 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
Ammonia Solution, Strong SCHEMBL7974729 0.98 CASP1 (0.51) CASP1MEN1KMT2ASMN1; SMN2NPC1
Trimethylammonium SCHEMBL2248924 0.95 CASP1 (0.49) CASP1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL5698446 0.88 MYC (0.42) CASP1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL30143351 0.86 MYC (0.43) CASP1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL4962913 0.86 MYC (0.41) CASP1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL28521154 0.86 MYC (0.41) CASP1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL6160456 0.86 SMN1; SMN2 (0.46) CASP1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL8741343 0.85 CASP1 (0.51) CASP1MEN1KMT2ASMN1; SMN2NPC1
Hydrazine SCHEMBL29100189 0.84 TTR (0.42) CASP1MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL5682949 0.81 CASP1 (0.49) CASP1MEN1KMT2ASMN1; SMN2NPC1

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-0973855-B1 BLEACH COMPOSITIONS CONTAINING METAL BLEACH CATALYST, AND BLEACH ACTIVATORS AND/OR ORGANIC PERCARBOXYLIC ACIDS PROCTER & GAMBLE (US) 2003-08-06 EP claimed
EP-0874896-B1 ENCAPSULATED BLEACH PARTICLES UNILEVER PLC (GB) 2000-08-09 EP claimed
CN-1291224-A granular composition with improved dissolution PROCTER & GAMBLE (US) 2001-04-11 CN disclosed