Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL9746471

COC(=O)c1ccc2nc(C(=O)[C@H](C(C)C)N3CCC[C@H]3C(=O)NC(=O)[C@@H](N)C(C)C)oc2c1.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.50

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.50
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CMA1 P23946 1/20 0.33
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL7286039 0.88 ELANE (0.52) ELANECMA1KMT2A
Trifluoromethanesulfonic Acid SCHEMBL7276309 0.81 ELANE (0.71) ELANE
Trifluoromethanesulfonic Acid SCHEMBL27291958 0.81 ELANE (0.71) ELANE
SCHEMBL7276968 0.75 ELANE (0.46) ELANECMA1KMT2A
SCHEMBL7289208 0.74 ELANE (0.47) ELANECMA1
SCHEMBL7279280 0.74 ELANE (0.61) ELANE
Trifluoromethanesulfonic Acid SCHEMBL7286712 0.73 HTT (0.34)
SCHEMBL7287031 0.69 ELANE (0.61) ELANEKMT2A
SCHEMBL7279637 0.68 ALOX15 (0.42) LMNASMN1; SMN2
SCHEMBL7860987 0.67 ELANE (0.37) ELANE

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
US-5164371-A HETEROCYCLIC KETONES ICI AMERICAS INC. (US) 1992-11-17 US disclosed