Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL14745501

CCc1cc(C(=O)O)c(=O)[nH]c1-c1ccc(N2CCC(N3CCOCC3)C2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.36
MCHR1 Q99705 1/20 0.35
PRCP P42785 4/20 0.35
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
ALK Q9UM73 2/20 0.34
DDR1 Q08345 1/20 0.34
MET P08581 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
WDR5 P61964 1/20 0.33
NOTUM Q6P988 1/20 0.33
FGFR1 P11362 1/20 0.33
DDR2 Q16832 1/20 0.33
CFTR P13569 1/20 0.33

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
SCHEMBL14758821 0.96 KCNH2 (0.38) KCNH2MCHR1PARP1PARP2L3MBTL1
SCHEMBL14745067 0.88 KCNH2 (0.39) KCNH2MCHR1PARP1PARP2L3MBTL1
SCHEMBL14745502 0.87 DDR1 (0.36) KCNH2MCHR1PARP1PARP2ALK
Trifluoroacetic Acid SCHEMBL14745223 0.85 DYRK1A (0.42) KCNH2DDR1NOTUM
Trifluoroacetic Acid SCHEMBL14741133 0.83 KCNH2 (0.53) KCNH2MCHR1WDR5
Trifluoroacetic Acid SCHEMBL17595148 0.83 KCNH2 (0.53) KCNH2MCHR1WDR5
Trifluoroacetic Acid SCHEMBL14744733 0.83 TOP1 (0.44) KCNH2LIPG
Trifluoroacetic Acid SCHEMBL14741239 0.82 KCNH2 (0.44) KCNH2MCHR1LIPGWDR5NOTUM
SCHEMBL14745306 0.82 KCNH2 (0.41) KCNH2MCHR1PARP1PARP2LIPG
SCHEMBL14741014 0.82 KCNH2 (0.41) KCNH2MCHR1PARP1PARP2LIPG

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
WO-2016039936-A2 MONOCYCLIC SUBSTITUTED 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-03-17 WO claimed
US-20150080362-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2015-03-19 US claimed
EP-2750505-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC Therapeutics, Inc. (US) 2014-07-09 EP claimed
WO-2013033240-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2013-03-07 WO claimed
EP-2750505-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC Therapeutics, Inc. (US) 2014-07-09 EP disclosed
WO-2013033240-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE PTC THERAPEUTICS, INC. (US) 2013-03-07 WO 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-20150080362-A1 ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE MRPL21, SLC11A2, CLPP KCNH2 3306/4885MCHR1 4817/4885PRCP 648/4885

“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.