Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6286376

NCCCC[C@@H](NC(=O)CCc1ccccc1O)C(=O)Nc1ccc(C(c2ccc(NC(=O)[C@@H](CCCCN)NC(=O)CCc3ccccc3O)cc2)c2ccc(NC(=O)[C@@H](CCCCN)NC(=O)CCc3ccccc3O)cc2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALCRL Q16602 2/20 0.46
PLG P00747 1/20 0.43
HDAC4 P56524 5/20 0.38
MEF2D Q14814 5/20 0.38
EP300 Q09472 1/20 0.38
SSTR3 P32745 1/20 0.37
KLKB1 P03952 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
MMP3 P08254 1/20 0.36
LTA4H P09960 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
NPY1R P25929 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
GRIA1 P42261 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36

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 SCHEMBL6286503 0.85 CALCRL (0.47) CALCRLNPY1RITGB3ITGA2BGRIA1
Trifluoroacetic Acid SCHEMBL6290997 0.85 CALCRL (0.47) CALCRLPLGMMP3LTA4HITGB3
Trifluoroacetic Acid SCHEMBL6287713 0.83 PLG (0.43) CALCRLPLGHDAC4MEF2DSSTR3
Trifluoroacetic Acid SCHEMBL6286278 0.83 CALCRL (0.47) CALCRLPLGHDAC4SSTR3LTA4H
Trifluoroacetic Acid SCHEMBL6288016 0.83 CALCRL (0.47) CALCRLPLGHDAC4SSTR3LTA4H
Trifluoroacetic Acid SCHEMBL6287789 0.81 HDAC4 (0.50) PLGHDAC4MEF2DCA1CA2
Trifluoroacetic Acid SCHEMBL6290915 0.81 HDAC4 (0.50) PLGHDAC4MEF2DCA1CA2
Hydrochloric Acid SCHEMBL6287855 0.80 CALCRL (0.50) CALCRLPLGHDAC4MEF2DSSTR3
Trifluoroacetic Acid SCHEMBL6286184 0.80 ANPEP (0.41) CALCRLPLGSSTR3LTA4HCA1
Trifluoroacetic Acid SCHEMBL6290840 0.79 LMNA (0.46) HDAC4

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-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP 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-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK CALCRL 464/4885PLG 718/4885HDAC4 4652/4885

“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.