SCHEMBL9018754

SCHEMBL9018754

CCCCCCCCCCCCCCCCCCCCCOS(=O)(=O)O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.61
CA2 P00918 10/20 0.61
CA9 Q16790 8/20 0.61
CA12 O43570 3/20 0.61
CA7 P43166 3/20 0.61
CA14 Q9ULX7 3/20 0.61
CA3 P07451 2/20 0.61
CA4 P22748 2/20 0.61
CA6 P23280 2/20 0.61
CA5A P35218 2/20 0.61
CA5B Q9Y2D0 2/20 0.61
RECQL P46063 2/20 0.59
GLA P06280 1/20 0.59
HPGD P15428 1/20 0.59
TSHR P16473 1/20 0.59
MAPK1 P28482 1/20 0.59
EPHX2 P34913 1/20 0.59
BLM P54132 1/20 0.59
CES2 O00748 1/20 0.48
FNTA P49354 2/20 0.46

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
SCHEMBL144603 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
Octadecyl Sulfate SCHEMBL41459 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL4904743 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
Octadecyl Sulfate SCHEMBL146302 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL2233821 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL374800 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL8076339 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL10583495 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL22283885 1.00 CA1 (0.61) CA1CA2CA9CA12CA7
SCHEMBL3353 1.00 CA1 (0.61) CA1CA2CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2705879-B1 COMBINATION OF OILS FOR ANTIPERSPIRANT COMPOSITIONS WITH IMPROVED WHITE MARK PROTECTION HENKEL AG & CO KGAA (DE) 2017-06-07 EP disclosed
EP-2705879-A1 COMBINATION OF OILS FOR ANTIPERSPIRANT COMPOSITIONS WITH IMPROVED WHITE MARK PROTECTION Henkel AG&Co. KGAA (DE) 2014-03-12 EP disclosed
EP-0609257-B1 METHOD OF PRODUCING IRON-ORE CONCENTRATES BY FROTH FLOTATION HENKEL KGAA (DE) 1996-06-12 EP disclosed
EP-0609257-A1 METHOD OF PRODUCING IRON-ORE CONCENTRATES BY FROTH FLOTATION. HENKEL KGAA (DE) 1994-08-10 EP disclosed
WO-1993006935-A1 METHOD OF PRODUCING IRON-ORE CONCENTRATES BY FROTH FLOTATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1993-04-15 WO disclosed