SCHEMBL6019813

SCHEMBL6019813

C=CCOS(=O)(=O)[O-].C=CCOS(=O)(=O)[O-].C=CCOS(=O)(=O)[O-].C=CCOS(=O)(=O)[O-].[C+4]

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA7 P43166 1/20 0.35
RECQL P46063 2/20 0.32
GLA P06280 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
EPHX2 P34913 1/20 0.32
BLM P54132 1/20 0.32

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
SCHEMBL62283 0.95
SCHEMBL10754911 0.95 CA2 (0.35) CA2CA9CA12CA1CA7
SCHEMBL9055925 0.95 CA2 (0.35) CA2CA9CA12CA1CA7
Silver SCHEMBL900458 0.95
Lithium Ion SCHEMBL2540922 0.95
SCHEMBL2537774 0.95
Zinc Ion SCHEMBL9055657 0.95 CA2 (0.35) CA2CA9CA12CA1CA7
SCHEMBL9056640 0.95 CA2 (0.35) CA2CA9CA12CA1CA7
SCHEMBL2546488 0.95
Potassium Ion SCHEMBL912084 0.95

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
US-20060024344-A1 Capsicum shark repellent MATOS GONZALO R 2006-02-02 US disclosed
US-5543073-A ANIONIC, NONIONIC SURFACTANTS, ETHER COSURFACTANT; SOLUBILIZING POWER COLGATE-PALMOLIVE COMPANY (US) 1996-08-06 US disclosed
EP-0620271-A1 Microemulsion cleaning composition comprising a glycol mono-alkyl ether Colgate-Palmolive Company (US) 1994-10-19 EP disclosed