SCHEMBL15780352

SCHEMBL15780352

Cc1ccc(S(=O)(=O)O)cc1[N+]#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.39
ALDH1A1 P00352 9/20 0.39
HSD17B10 Q99714 4/20 0.39
LMNA P02545 3/20 0.38
TDP1 Q9NUW8 3/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 3/20 0.36
NT5E P21589 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL2618019 0.79 ALDH1A1 (0.40) SNCAALDH1A1HSD17B10LMNATDP1
SCHEMBL27904286 0.78 ALDH1A1 (0.52) ALDH1A1HSD17B10LMNATDP1GAA
SCHEMBL30487906 0.76 LMNA (0.61) SNCAALDH1A1HSD17B10LMNATDP1
SCHEMBL83885 0.76 LMNA (0.61) SNCAALDH1A1HSD17B10LMNATDP1
Sulfuric Acid SCHEMBL8930784 0.75 ALDH1A1 (0.51) ALDH1A1HSD17B10LMNATDP1MAPT
SCHEMBL10488538 0.75 ALDH1A1 (0.42) SNCAALDH1A1HSD17B10LMNATDP1
Hydrochloric Acid SCHEMBL3425440 0.74 TIMP3 (0.40) SNCAALDH1A1HSD17B10LMNATDP1
SCHEMBL6913755 0.74 LMNA (0.59) SNCAALDH1A1HSD17B10LMNATDP1
SCHEMBL7022903 0.74 LMNA (0.59) SNCAALDH1A1HSD17B10LMNATDP1
SCHEMBL563388 0.74 ALDH1A1 (0.55) SNCAALDH1A1HSD17B10LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9714347-B2 Metal free acid dyes, process for the production thereof and their use DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2017-07-25 US disclosed
EP-2928966-B1 METAL FREE ACID DYES, PROCESS FOR THE PRODUCTION THEREOF AND THEIR USE DYSTAR COLOURS DISTRIB GMBH (DE) 2016-10-12 EP disclosed
US-20150315386-A1 METAL FREE ACID DYES, PROCESS FOR THE PRODUCTION THEREOF AND THEIR USE DyStar Coulours Distribution GmbH (DE) 2015-11-05 US disclosed
EP-2740769-A1 Metal free acid dyes, process for the production thereof and their use DyStar Colours Distribution GmbH (DE) 2014-06-11 EP disclosed