Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7874384

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.c1ccc2c(NCCNc3c4ccccc4nc4ccccc34)c3ccccc3nc2c1

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 7/20 0.63
RAD52 P43351 5/20 0.63
KDM4E B2RXH2 5/20 0.63
GLA P06280 4/20 0.63
GAA P10253 4/20 0.63
RAB9A P51151 3/20 0.63
LMNA P02545 3/20 0.63
ALDH1A1 P00352 2/20 0.63
MITF O75030 2/20 0.63
TTR P02766 1/20 0.63
TOP2A P11388 4/20 0.56
KMT2A Q03164 7/20 0.51
SLC2A1 P11166 3/20 0.51
NPC1 O15118 2/20 0.51
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
HPGD P15428 1/20 0.50
ATM Q13315 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
GFER P55789 2/20 0.49

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
SCHEMBL7880366 0.84 POLB (0.78) POLBRAD52KDM4EGLAGAA
SCHEMBL3360006 0.80 POLB (0.67) POLBRAD52KDM4EGLAGAA
SCHEMBL14740610 0.79 POLB (0.61) POLBRAD52KDM4EGLAGAA
Trifluoroacetic Acid SCHEMBL8273518 0.78 KDM4E (0.48) POLBRAD52KDM4EGLAGAA
SCHEMBL15867898 0.78 POLB (0.59) POLBRAD52KDM4EGLAGAA
Trifluoroacetic Acid SCHEMBL7875800 0.78 GSR (0.72) KDM4EKMT2AMEN1
SCHEMBL17154415 0.78 POLB (1.00) POLBRAD52KDM4EGLAGAA
SCHEMBL7869214 0.77 POLB (0.79) POLBRAD52KDM4EGLAGAA
SCHEMBL5578493 0.77 POLB (0.79) POLBRAD52KDM4EGLAGAA
SCHEMBL15867118 0.76 POLB (0.67) POLBRAD52KDM4EGLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010031763-A1 Substituted bis-acridines and related compounds as CCR5 receptor ligands, anti-inflammatory agents and anti-viral agents SMITHKLINE BEECHAM CORPORATION 2001-10-18 US claimed
EP-0979078-A4 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2000-06-21 EP claimed
EP-0979078-A1 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-16 EP claimed
WO-1998030218-A1 SUBSTITUTED BIS-ACRIDINES AND RELATED COMPOUNDS AS CCR5 RECEPTOR LIGANDS, ANTI-INFLAMMATORY AGENTS AND ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 1998-07-16 WO claimed
EP-4143235-A1 METHODS AND COMPOSITIONS FOR TREATING CYTOKINE STORM INFECTIONS, INCLUDING COVID-19, BY INHIBITING CCR5/CCL5 INTERACTION IncellDx, Inc. (US) 2023-03-08 EP disclosed
WO-2021222069-A1 METHODS AND COMPOSITIONS FOR TREATING CYTOKINE STORM INFECTIONS, INCLUDING COVID-19, BY INHIBITING CCR5/CCL5 INTERACTION INCELLDX, INC. (US) 2021-11-04 WO disclosed
US-20010031763-A1 Substituted bis-acridines and related compounds as CCR5 receptor ligands, anti-inflammatory agents and anti-viral agents SMITHKLINE BEECHAM CORPORATION 2001-10-18 US disclosed
US-6242459-B1 Substituted bis-acridines and related compounds as CCR5 receptor ligands, anti-inflammatory agents and anti-viral agents SMITHKLINE BEECHAM CORPORATION 2001-06-05 US 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 (1 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-20010031763-A1 Substituted bis-acridines and related compounds as CCR5 receptor ligands, anti-inflammatory agents and anti-viral agents CCR5, CCR2, CCR1 POLB 2481/4885RAD52 3064/4885KDM4E 4247/4885

“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.