SCHEMBL7837586

SCHEMBL7837586

CCCCC(C[N]c1ccccc1)S(=O)(=O)CCCl

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.38
MMP7 P09237 4/20 0.38
MMP12 P39900 4/20 0.38
MMP13 P45452 4/20 0.38
ACE P12821 3/20 0.38
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
CNR2 P34972 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7761100 0.76 MMP1 (0.40) MMP1MMP7MMP12MMP13ACE
SCHEMBL10391715 0.70 ALDH1A1 (0.33) POLBSMN1; SMN2
SCHEMBL8080625 0.70 MMP1 (0.34) MMP1MMP7MMP12MMP13ACE
SCHEMBL8704234 0.70 CA2 (0.37) TDP1
SCHEMBL7841234 0.69
SCHEMBL20306093 0.69 CA2 (0.43)
SCHEMBL7828762 0.69 GRIA4 (0.31) SMN1; SMN2
SCHEMBL7756158 0.64 CA2 (0.33) POLB
SCHEMBL7801205 0.63 CA2 (0.32) POLBTDP1
SCHEMBL7840761 0.63 KEAP1 (0.36)

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-0675172-B1 Water-solable azo compounds, process for their preparation and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-11 EP disclosed
US-5539088-A PROVIDE DYEINGS IN BRILLIANT SHADES WITH GOOD FASTNESS PROPERTIES AND HIGH DEGREE OF FIXATION HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed
EP-0629667-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-21 EP disclosed