SCHEMBL6473909

SCHEMBL6473909

COc1cccc(NS(=O)(=O)O)c1C

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
P2RX7 Q99572 1/20 0.43
ALDH1A1 P00352 3/20 0.43
NAMPT P43490 1/20 0.42
NR3C1 P04150 1/20 0.41
POLB P06746 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
HTT P42858 2/20 0.41
RAD52 P43351 1/20 0.41

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
SCHEMBL5637788 0.84 KEAP1 (0.62) LMNASMN1; SMN2KEAP1NFE2L2ALDH1A1
SCHEMBL7051503 0.84 ALDH1A1 (0.55) LMNASMN1; SMN2NFE2L2ALDH1A1POLB
SCHEMBL18599533 0.80 NR3C1 (0.50) LMNASMN1; SMN2KEAP1NFE2L2P2RX7
SCHEMBL11672581 0.78 KEAP1 (0.69) LMNAKEAP1NFE2L2ALDH1A1POLB
SCHEMBL30673310 0.78 PTGS1 (0.47) LMNAALDH1A1NR3C1
SCHEMBL26928509 0.78 PTGS1 (0.47) LMNAALDH1A1NR3C1
SCHEMBL11415903 0.76 P2RX7 (0.44) LMNASMN1; SMN2P2RX7ALDH1A1HTT
SCHEMBL11973136 0.75 MAPT (0.53) LMNASMN1; SMN2KEAP1NFE2L2ALDH1A1
SCHEMBL20597533 0.74 P2RX7 (0.53) SMN1; SMN2P2RX7ALDH1A1HTT
SCHEMBL1141399 0.74 P2RX7 (0.53) SMN1; SMN2P2RX7ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6916350-B2 Dye mixture of water-soluble fiber-reactive azo dyes, method for the production and use thereof DYSTAR TEXTIFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2005-07-12 US disclosed
US-20030145396-A1 Dye mixture of water-soluble fiber-reactive azo dyes, method for the production and use thereof DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2003-08-07 US disclosed