SCHEMBL8213587

SCHEMBL8213587

CCc1cc(S(=O)(=O)O)c(N)cc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 1/20 0.41
TTR P02766 1/20 0.36
HSD17B10 Q99714 6/20 0.35
HIF1A Q16665 2/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
ALDH1A1 P00352 7/20 0.33
POLB P06746 3/20 0.33
CASP7 P55210 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CASP6 P55212 2/20 0.33
BRD4 O60885 1/20 0.33
TP53 P04637 1/20 0.33
CREBBP Q92793 1/20 0.33
HTT P42858 1/20 0.33
CASP1 P29466 1/20 0.33
CYP1A2 P05177 1/20 0.33
ALOX15 P16050 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33

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
SCHEMBL7756170 0.88 CTDSP1 (0.41) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL8914203 0.88 CTDSP1 (0.38) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL10489986 0.83 CA12 (0.43) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL9155359 0.83 CTDSP1 (0.38) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL9168147 0.82 CTDSP1 (0.38) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL9449428 0.80 BRD4 (0.41) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL427123 0.80 TTR (0.45) CTDSP1TTRHSD17B10HPGDALDH1A1
SCHEMBL10966242 0.79 CA1 (0.39) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL5524737 0.79 CTDSP1 (0.38) CTDSP1TTRHSD17B10HIF1ALMNA
SCHEMBL2468560 0.79 CA12 (0.39) CTDSP1TTRHSD17B10HIF1ALMNA

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
EP-1000123-A2 USE OF REACTIVE DYES FOR DYEING HAIR BASF AKTIENGESELLSCHAFT (DE) 2000-05-17 EP disclosed
EP-0929610-A1 REACTIVE DYES WITH A HETEROCYCLIC ANCHOR BASF AKTIENGESELLSCHAFT (DE) 1999-07-21 EP disclosed
WO-1999005222-A2 USE OF REACTIVE DYES FOR DYEING HAIR BASF AKTIENGESELLSCHAFT (DE) 1999-02-04 WO disclosed
WO-1998014522-A1 REACTIVE DYES WITH A HETEROCYCLIC ANCHOR BASF AKTIENGESELLSCHAFT (DE) 1998-04-09 WO disclosed