Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3600528

CC(=O)Nc1ccccc1C(N)=O.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.57
CYP2C19 P33261 2/20 0.57
POLB P06746 2/20 0.57
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
HPGD P15428 2/20 0.51
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
RXFP1 Q9HBX9 1/20 0.49
HTT P42858 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL894741 0.88 SIRT2 (0.70) SIRT2CYP2C19POLBKDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL8887269 0.81 SMN1; SMN2 (0.46) SIRT2CYP2C19POLBKDM4EALDH1A1
Anthranilamide SCHEMBL2985093 0.81 SIRT2 (0.60) SIRT2CYP2C19POLBKDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL3600531 0.81 HDAC1 (0.54) CYP2C19POLBALDH1A1SMN1; SMN2NPC1
SCHEMBL8645992 0.80 KDM4E (0.55) SIRT2POLBKDM4EALDH1A1SMN1; SMN2
Valine SCHEMBL5940586 0.78 SIRT2 (0.54) SIRT2CYP2C19POLBKDM4EALDH1A1
Hydroxyamine SCHEMBL4368974 0.76 POLB (0.68) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL1409830 0.76 KDM4E (0.64) SIRT2POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL110042 0.76 POLB (0.72) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2
SCHEMBL29437050 0.76 POLB (0.72) CYP2C19POLBKDM4EALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121612-B1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2014-10-01 EP disclosed
US-8299102-B2 Heteroarylcyclopropanecarboxamides and their use as pharmaceuticals SANOFI (FR) 2012-10-30 US disclosed
US-20100016278-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2010-01-21 US disclosed
EP-2121612-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis (FR) 2009-11-25 EP disclosed
WO-2008080511-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2008-07-10 WO disclosed
EP-1942104-A1 Heteroarylcyclopropanecarboxamides and their use as pharmaceuticals sanofi-aventis (FR) 2008-07-09 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-20100016278-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS PTGIS, TBXAS1, EDNRA SIRT2 2954/4885CYP2C19 89/4885POLB 2658/4885

“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.