Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1832229

CNCCO.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
FUCA1 P04066 1/20 0.36
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
EPHX1 P07099 1/20 0.32
CACNA1B Q00975 2/20 0.32
KDM4E B2RXH2 2/20 0.32
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31
CA3 P07451 2/20 0.30
CA5A P35218 2/20 0.30
CA5B Q9Y2D0 2/20 0.30
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL1839042 0.85 THRB (0.37) ALDH1A1
Trifluoroacetic Acid SCHEMBL22500043 0.83 MEN1 (0.42) ALDH1A1FUCA1POLBSMN1; SMN2MEN1
Bicarbonate SCHEMBL600163 0.82
Bicarbonate SCHEMBL1830889 0.82 MEN1 (0.36) ALDH1A1CYP3A4TSHRMEN1KMT2A
SCHEMBL1833176 0.81 THRB (0.48) ALDH1A1
Trifluoroacetic Acid SCHEMBL27176216 0.81 EPHX1 (0.41) ALDH1A1FUCA1POLBSMN1; SMN2MEN1
Trifluoroacetic Acid SCHEMBL356545 0.80 CA3 (0.41) ALDH1A1FUCA1POLBSMN1; SMN2CYP3A4
Oxalic Acid SCHEMBL1837735 0.79 KDM4E (0.39) ALDH1A1POLBSMN1; SMN2CYP3A4TSHR
Acetic Acid SCHEMBL1832152 0.79
Trifluoroacetic Acid SCHEMBL17746797 0.79 HDAC6 (0.36) ALDH1A1FUCA1POLBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US claimed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 EP disclosed
CN-101316810-A Ionic liquids BIONIQS LTD (GB) 2008-12-03 CN disclosed
US-20080221361-A1 Ionic Liquids BIONIQS LIMITED (GB) 2008-09-11 US disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US disclosed