SCHEMBL7180736

SCHEMBL7180736

[O]c1ccccc1S(=O)(=O)Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.48
CA2 P00918 3/20 0.48
CA9 Q16790 3/20 0.48
LMNA P02545 2/20 0.46
TDP1 Q9NUW8 2/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
POLB P06746 1/20 0.41
PPARG P37231 1/20 0.40
NFE2L2 Q16236 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ITGA1 P56199 1/20 0.37
PGR P06401 3/20 0.37

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
SCHEMBL6357382 0.78 CA1 (0.52) CA1CA2CA9LMNATDP1
SCHEMBL6580142 0.78 CA1 (0.47) CA1CA2CA9LMNATDP1
SCHEMBL1176512 0.78 CA1 (0.47) CA1CA2CA9LMNATDP1
SCHEMBL196710 0.78 TDP1 (0.52) CA1CA2CA9LMNATDP1
SCHEMBL6913682 0.78 CA1 (0.47) CA1CA2CA9LMNATDP1
SCHEMBL534724 0.78 GAA (0.54) CA1CA2CA9LMNATDP1
SCHEMBL19280567 0.78 KMT2A (0.67) CA1CA2CA9LMNATDP1
SCHEMBL6912873 0.78 POLB (0.62) CA1CA2CA9LMNATDP1
SCHEMBL10849987 0.78 CA1 (0.52) CA1CA2CA9LMNATDP1
SCHEMBL29516284 0.78 GAA (0.54) CA1CA2CA9LMNATDP1

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-1027288-B1 STABILIZED CONCENTRATES OF WATER UNSTABLE AZA COMPOUNDS AND O/W MINIEMULSIONS THEREOF ISP INVESTMENTS INC (US) 2003-09-03 EP disclosed
EP-1027288-A4 STABILIZED CONCENTRATES OF WATER UNSTABLE AZA COMPOUNDS AND O/W MINIEMULSIONS THEREOF ISP INVESTMENTS INC (US) 2001-07-18 EP disclosed
EP-1027288-A2 STABILIZED CONCENTRATES OF WATER UNSTABLE AZA COMPOUNDS AND O/W MINIEMULSIONS THEREOF ISP INVESTMENTS INC. (US) 2000-08-16 EP disclosed
WO-1999019256-A2 STABILIZED CONCENTRATES OF WATER UNSTABLE AZA COMPOUNDS AND O/W MINIEMULSIONS THEREOF ISP INVESTMENTS INC. (US) 1999-04-22 WO disclosed