Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8559818

O=C(O)C(F)(F)F.O=C(O)COc1ccc(C(=O)CNC(=O)CC2CCNCC2)cc1OCC(=O)O

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 12/20 0.75
ITGA2B P08514 12/20 0.75
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
ROCK2 O75116 1/20 0.36
BRD4 O60885 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
F2 P00734 1/20 0.35

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
Trifluoroacetic Acid SCHEMBL8554642 0.91 ITGB3 (0.90) ITGB3ITGA2BMEN1KMT2AROCK2
Trifluoroacetic Acid SCHEMBL8556791 0.90 ITGB3 (0.80) ITGB3ITGA2BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8555841 0.82 ITGB3 (0.55) ITGB3ITGA2BMEN1KMT2APTGDR2
SCHEMBL7293558 0.79 ITGB3 (0.61) ITGB3ITGA2BMEN1KMT2AROCK2
Trifluoroacetic Acid SCHEMBL8558440 0.77 ITGB3 (0.62) ITGB3ITGA2BMEN1KMT2APTGDR2
Trifluoroacetic Acid SCHEMBL8553663 0.77 ITGB3 (0.88) ITGB3ITGA2BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8832901 0.76 ITGB3 (0.52) ITGB3ITGA2BMEN1KMT2APTGDR2
Trifluoroacetic Acid SCHEMBL8555606 0.75 ITGB3 (0.64) ITGB3ITGA2BMEN1KMT2A
Trifluoroacetic Acid SCHEMBL8553251 0.75 ITGB3 (0.69) ITGB3ITGA2BMEN1KMT2APTGDR2
Trifluoroacetic Acid SCHEMBL8835830 0.74 ITGB3 (0.44) ITGB3ITGA2BPTGDR2BRD4F2

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
EP-0641770-B1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA CO (JP) 1998-05-13 EP disclosed
US-5594004-A CARDIOVASCULAR DISORDERS AND ANTICOAGULANTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-01-14 US disclosed
EP-0641770-A1 NOVEL COMPOUND WITH PLATELET AGGREGATION INHIBITOR ACTIVITY MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-03-08 EP disclosed