SCHEMBL5322110

SCHEMBL5322110

COC(=O)c1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.62
CA2 P00918 6/20 0.62
CA12 O43570 5/20 0.62
CA9 Q16790 5/20 0.62
CA14 Q9ULX7 5/20 0.62
GLA P06280 1/20 0.60
FBP1 P09467 1/20 0.59
TDP1 Q9NUW8 1/20 0.57
POLB P06746 1/20 0.57
CA7 P43166 1/20 0.57
STS P08842 1/20 0.55
TSHR P16473 1/20 0.54
HPGD P15428 2/20 0.53
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
RAB9A P51151 1/20 0.51

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
SCHEMBL6653479 0.98 CA1 (0.61) CA1CA2CA12CA9CA14
Isobutane SCHEMBL27943354 0.94 CA1 (0.57) CA1CA2CA12CA9CA14
SCHEMBL9726291 0.89 ACR (0.61) CA1CA2CA12CA9CA14
SCHEMBL68518 0.85 POLB (0.74) CA1CA2CA12CA9CA14
SCHEMBL2228992 0.83 CA1 (0.62) CA1CA2CA12CA9CA14
SCHEMBL29190736 0.83 LMNA (0.50) CA1CA2CA12CA9CA14
SCHEMBL20531679 0.83 LMNA (0.50) CA1CA2CA12CA9CA14
SCHEMBL270676 0.82 CA12 (0.57) CA1CA2CA12CA9CA14
SCHEMBL23600 0.82 CA1 (0.80) CA1CA2CA12CA9CA14
SCHEMBL28993944 0.82 CA1 (0.80) CA1CA2CA12CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4063889-A Halosolvent dyeing process for polyester with cationic dyes having sulfosuccinate anions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-12-20 US claimed
US-20220066319-A1 POSITIVE RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-03-03 US disclosed
EP-1770129-B1 Modified carbocyanine dyes and their conjugates LIFE TECHNOLOGIES CORP (US) 2012-07-25 EP disclosed
EP-1770129-A2 Modified carbocyanine dyes and their conjugates Molecular Probes, Inc. (US) 2007-04-04 EP disclosed
EP-0243584-A1 Process for the production of arylsulfonyl halides STAUFFER CHEMICAL COMPANY (US) 1987-11-04 EP disclosed
US-4696774-A Decolorizing arylsulfonyl halides STAUFFER CHEMICAL COMPANY (US) 1987-09-29 US disclosed
US-4678612-A PHOSPHORUS COMPOUND TO PREVENT DECOMPOSITION OF DISTILLATION RESIDUE STAUFFER CHEMICAL COMPANY (US) 1987-07-07 US disclosed
US-4063889-A Halosolvent dyeing process for polyester with cationic dyes having sulfosuccinate anions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-12-20 US disclosed