SCHEMBL9687875

SCHEMBL9687875

FC(F)(F)C(F)(F)C(F)(F)C(F)(F)CCN=C=S

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.37
MIF P14174 3/20 0.35
NAAA Q02083 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
SCHEMBL9687670 0.98 TRPA1 (0.35) TRPA1MIFNAAA
SCHEMBL9686583 0.98 TRPA1 (0.35) TRPA1MIFNAAA
SCHEMBL9686570 0.80
SCHEMBL9687658 0.80
SCHEMBL1096758 0.80 TRPA1 (0.32) TRPA1
SCHEMBL2761447 0.78
SCHEMBL3780469 0.77
SCHEMBL2760845 0.77
SCHEMBL3777063 0.77
SCHEMBL3777062 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3027352-A None JP disclosed
US-5107021-A Betaines, surface-active agents SOCIETE ATOCHEM (FR) 1992-04-21 US disclosed
US-5026910-A Used as surface-active agents SOCIETE ATOCHEM (FR) 1991-06-25 US disclosed
JP-H0327352-A POLYFLUOROALKYL NITROGEN COMPOUND, ITS PREPARATION AND ITS APPLICATION SOC ATOCHEM 1991-02-05 JP disclosed