SCHEMBL9079331

SCHEMBL9079331

CCCCOC(C)OS(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
CA1 P00915 10/20 0.38
CA2 P00918 10/20 0.38
ALDH1A1 P00352 1/20 0.34
CA9 Q16790 8/20 0.32
ATM Q13315 1/20 0.32
STS P08842 1/20 0.32
CA12 O43570 3/20 0.31
CA7 P43166 3/20 0.31
CA14 Q9ULX7 3/20 0.31
CA3 P07451 2/20 0.31
CA4 P22748 2/20 0.31
CA6 P23280 2/20 0.31
CA5A P35218 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31

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
Ammonia Solution, Strong SCHEMBL7132558 0.98 TP53 (0.37) TP53CA1CA2ALDH1A1CA9
SCHEMBL723644 0.92 CA1 (0.41) TP53CA1CA2CA9CA12
SCHEMBL987798 0.92 CA1 (0.41) TP53CA1CA2CA9CA12
SCHEMBL987423 0.92 CA1 (0.41) TP53CA1CA2CA9CA12
SCHEMBL1276368 0.92 CA1 (0.41) TP53CA1CA2CA9CA12
SCHEMBL718849 0.91 CA1 (0.40) TP53CA1CA2CA9CA12
SCHEMBL15269942 0.88 CA1 (0.33) TP53CA1CA2
SCHEMBL11044079 0.83 CA1 (0.40) TP53CA1CA2ALDH1A1CA9
Ammonia Solution, Strong SCHEMBL28051397 0.83 TP53 (0.33) TP53CA1CA2
SCHEMBL22075792 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0479888-B1 IMPROVED BUILDER-CONTAINING AQUEOUS CLEANER/DEGREASER MICROEMULSION COMPOSITIONS BUCKEYE INT (US) 1996-12-18 EP claimed
EP-0479888-B1 IMPROVED BUILDER-CONTAINING AQUEOUS CLEANER/DEGREASER MICROEMULSION COMPOSITIONS BUCKEYE INT (US) 1996-12-18 EP disclosed
EP-0479888-A4 IMPROVED BUILDER-CONTAINING AQUEOUS CLEANER/DEGREASER MICROEMULSION COMPOSITIONS 1992-06-03 EP disclosed
EP-0479888-A1 IMPROVED BUILDER-CONTAINING AQUEOUS CLEANER/DEGREASER MICROEMULSION COMPOSITIONS. BUCKEYE INT (US) 1992-04-15 EP disclosed
WO-1991000337-A1 IMPROVED BUILDER-CONTAINING AQUEOUS CLEANER/DEGREASER MICROEMULSION COMPOSITIONS BUCKEYE INTERNATIONAL, INC. (US) 1991-01-10 WO disclosed
US-4476037-A INCLUDING A MONO-OR DISULFATE OF A POLYOX= ALKYLENE GLYCOL AS FLOWCONTROL AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1984-10-09 US disclosed
US-4384978-A Aqueous concentrates of a tenside of the sulfate and sulfonate type and process for the improvement of the flow behavior of difficultly pourable aqueous tenside concentrates HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1983-05-24 US disclosed