SCHEMBL3722966

SCHEMBL3722966

CCCCC(F)S(=O)(=O)NS(=O)(=O)C(F)CCCC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.35
CA2 P00918 8/20 0.34
CA1 P00915 6/20 0.34
CA12 O43570 1/20 0.34
CA7 P43166 1/20 0.34
CA14 Q9ULX7 1/20 0.34
FAAH O00519 2/20 0.33
MAPT P10636 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
FDPS P14324 1/20 0.32
DNM1 Q05193 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
SCHEMBL9164824 0.76 FDPS (0.39) EPHX1CA2FAAHMAPTTP53
SCHEMBL6009008 0.76 FAAH (0.41) EPHX1CA2CA1FAAHMAPT
SCHEMBL18008605 0.74 TP53 (0.43) EPHX1CA2CA1FAAHMAPT
SCHEMBL28234303 0.74 CA2 (0.48) CA2CA1CA12CA7CA14
Dimethylamine SCHEMBL19812257 0.74 TP53 (0.39) EPHX1CA2CA1MAPTTP53
SCHEMBL30430788 0.74 MAPT (0.40) EPHX1CA2FAAHMAPTTP53
Lithium Ion SCHEMBL19811155 0.73 CA2 (0.34) CA2CA1FAAHMAPTTP53
Ammonia Solution, Strong SCHEMBL19811135 0.73 TP53 (0.42) EPHX1CA2CA1FAAHMAPT
SCHEMBL19811115 0.73 CA2 (0.38) CA2FAAHMAPTTP53TSHR
Potassium Ion SCHEMBL19811679 0.73 FDFT1 (0.35) CA2FAAHMAPTTP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2258706-A2 Functionalized ionic liquids, and methods of use thereof UNIVERSITY OF SOUTH ALABAMA (US) 2010-12-08 EP disclosed