SCHEMBL481618

SCHEMBL481618

O=C1c2ccccc2C(=O)N1c1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 6/20 0.69
CA2 P00918 5/20 0.69
SCN2A Q99250 4/20 0.69
CA12 O43570 4/20 0.69
CA1 P00915 4/20 0.69
KDM4E B2RXH2 1/20 0.60
NPSR1 Q6W5P4 1/20 0.58
LMNA P02545 1/20 0.57
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
NR1H3 Q13133 1/20 0.51
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
DUSP22 Q9NRW4 1/20 0.49
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL29541147 1.00 CA9 (0.69) CA9CA2SCN2ACA12CA1
SCHEMBL14502329 0.85 CA1 (0.69) CA9CA2SCN2ACA12CA1
SCHEMBL9438146 0.85 CA1 (0.73) CA9CA2SCN2ACA12CA1
SCHEMBL4649471 0.82 KMT2A (0.78) CA9CA2SCN2ACA12CA1
SCHEMBL10833360 0.82 ESR1 (0.59) CA9CA2SCN2ACA12CA1
SCHEMBL10833363 0.82 ESR1 (0.59) CA9CA2SCN2ACA12CA1
SCHEMBL1548435 0.81 CA2 (1.00) CA9CA2SCN2ACA12CA1
SCHEMBL2412820 0.81 CA1 (0.69) CA9CA2SCN2ACA12CA1
Lithium Ion SCHEMBL10975499 0.81 CA1 (0.69) CA9CA2SCN2ACA12CA1
SCHEMBL12285301 0.81 CA9 (0.69) CA9CA2SCN2ACA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723425-B2 Pigment compositions with modified ATRP copolymer dispersants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-05-25 US claimed
WO-2020150446-A1 SMALL MOLECULE DIRECT INHIBITORS OF KEAP1-NRF2 PROTEIN-PROTEIN INTERACTION RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-07-23 WO disclosed
WO-2020150446-A1 SMALL MOLECULE DIRECT INHIBITORS OF KEAP1-NRF2 PROTEIN-PROTEIN INTERACTION RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2020-07-23 WO disclosed
EP-1465935-B1 PIGMENT COMPOSITIONS WITH MODIFIED ATRP COPOLYMER DISPERSANTS BASF SE (DE) 2016-09-07 EP disclosed
EP-2411437-B9 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK CHEMIE GMBH (DE) 2013-07-31 EP disclosed
EP-2411437-B1 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK CHEMIE GMBH (DE) 2013-05-08 EP disclosed
EP-1611197-B1 LIGHT STABILISING POLYMER DISPERSANTS IN PIGMENT DISPERSIONS BASF SE (DE) 2012-03-21 EP disclosed
US-20120029104-A1 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK-CHEMIE GMBH (DE) 2012-02-02 US disclosed
EP-2411437-A2 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK-Chemie GmbH (DE) 2012-02-01 EP disclosed
WO-2010108672-A2 COMPOSITION COMPRISING STABLE POLYOL MIXTURES BYK-CHEMIE GMBH (DE) 2010-09-30 WO disclosed
US-20060229407-A1 Light stabilising polymer dispersants in pigment dispersions CIBA SPECIALTY CHEMICALS CORP. 2006-10-12 US disclosed
US-20060160940-A1 Process for intercalating natural or szynthetic clays with block or comb copolymers CIBA SPECIALTY CHEMICALS CORP. 2006-07-20 US disclosed
US-6849679-B2 Pigment compositions with modified block copolymer dispersants CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-02-01 US disclosed