Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3596917

NC(=O)c1cccc(F)c1F.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.55
CES1 P23141 3/20 0.55
BCHE P06276 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 2/20 0.44
ALB P02768 1/20 0.43
KAT6A Q92794 1/20 0.41
BCAT2 O15382 1/20 0.39
PARP1 P09874 2/20 0.39
PDK2 Q15119 1/20 0.39
AURKA O14965 1/20 0.39
PDPK1 O15530 1/20 0.39
RPS6KB1 P23443 1/20 0.39
PBRM1 Q86U86 1/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KLK1 P06870 1/20 0.38

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
SCHEMBL29528396 0.89 CES2 (0.68) CES2CES1BCHEHPGDALB
SCHEMBL203112 0.89 CES2 (0.68) CES2CES1BCHEHPGDALB
SCHEMBL28943808 0.87 CES2 (0.65) CES2CES1BCHEHPGDALB
Hydrochloric Acid SCHEMBL8568449 0.87 CES2 (0.65) CES2CES1BCHEHPGDALB
Hydrochloric Acid SCHEMBL27985465 0.87 CES2 (0.65) CES2CES1BCHEHPGDALB
Trifluoroacetic Acid SCHEMBL1788206 0.85 CES2 (0.52) CES2CES1L3MBTL1HPGDALB
Formic Acid SCHEMBL15094034 0.81 CES2 (0.59) CES2CES1BCHEHPGDALB
Trifluoroacetic Acid SCHEMBL31255312 0.80 BCAT2 (0.46) CES2CES1L3MBTL1HPGDALB
Trifluoroacetic Acid SCHEMBL15568889 0.79 CES1 (0.50) CES2CES1L3MBTL1ALBPARP1
Trifluoroacetic Acid SCHEMBL12480281 0.79 SCN9A (0.44) L3MBTL1

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 7 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
EP-1761542-B1 OCTAHYDROPYRROLO[3,4-C]PYRROLE DERIVATIVES AN THEIR USE AS ANTIVIRAL AGENTS HOFFMANN LA ROCHE (CH) 2008-01-02 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 CES2 98/4885CES1 68/4885BCHE 370/4885

“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.