Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL17294018

Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCCCCCC(=O)N2CCNCCNCCNCC2)[C@@H](O)[C@H]1O.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[Ni+2]

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PRKACA P17612 6/20 0.64
▸ ROCK2 O75116 1/20 0.64
▸ ADORA3 P0DMS8 2/20 0.61
▸ ADORA2B P29275 1/20 0.61
▸ HSP90B1 P14625 1/20 0.59
▸ METTL3 Q86U44 1/20 0.59
▸ METTL14 Q9HCE5 1/20 0.59
▸ ADORA2A P29274 1/20 0.58
▸ ADORA1 P30542 1/20 0.58

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
Trifluoromethanesulfonic Acid SCHEMBL17293997 0.99 PRKACA (0.64) PRKACAROCK2ADORA3ADORA2BHSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730461 0.99 PRKACA (0.64) PRKACAROCK2ADORA3ADORA2BHSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730564 0.99 PRKACA (0.64) PRKACAROCK2ADORA3ADORA2BHSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730450 0.99 PRKACA (0.64) PRKACAROCK2ADORA3ADORA2BHSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730515 0.98 PRKACA (0.63) PRKACAROCK2ADORA3ADORA2BHSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730499 0.96 ADORA3 (0.62) PRKACAROCK2ADORA3ADORA2BHSP90B1
Trifluoromethanesulfonic Acid SCHEMBL18730518 0.93 ADORA3 (0.64) PRKACAROCK2ADORA3ADORA2BHSP90B1
SCHEMBL17294035 0.92 PRKACA (0.75) PRKACAROCK2HSP90B1METTL3METTL14
SCHEMBL17294015 0.92 PRKACA (0.75) PRKACAROCK2HSP90B1METTL3METTL14
SCHEMBL17294023 0.92 PRKACA (0.73) PRKACAROCK2HSP90B1METTL3METTL14

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-10077284-B2 UBA5 inhibitors THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2018-09-18 — — US disclosed
US-20170107247-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2017-04-20 — — US disclosed
WO-2015179955-A1 UBA5 INHIBITORS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2015-12-03 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10077284-B2 UBA5 inhibitors UBQLN2, UBTF, UBQLN1 PRKACA 2626/4885ROCK2 3602/4885ADORA3 4605/4885
US-20170107247-A1 UBA5 INHIBITORS UBQLN2, UBTF, UBQLN1 PRKACA 2626/4885ROCK2 3602/4885ADORA3 4605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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