Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7847239

Cc1nc(N2CC3CCOC3(CN)C2)c(Cl)c2c1c(=O)c(C(=O)O)cn2C1CC1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 2/20 0.37
CACNA1F O60840 1/20 0.37
MAPK1 P28482 1/20 0.37
CACNA1D Q01668 1/20 0.37
CACNA1S Q13698 1/20 0.37
CACNA1C Q13936 1/20 0.37
TOP2A P11388 4/20 0.37
TOP2B Q02880 4/20 0.37
CHRM2 P08172 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CHRM1 P11229 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
PIM1 P11309 1/20 0.34
CDK2 P24941 1/20 0.34
FLT4 P35916 1/20 0.34
CSNK2A1 P68400 1/20 0.34

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 SCHEMBL7496710 0.89 KCNH2 (0.33) KCNH2
SCHEMBL7995316 0.89 KCNH2 (0.33) KCNH2MEN1KMT2APOLBCACNA1F
SCHEMBL7495327 0.83 MEN1 (0.34) KCNH2MEN1KMT2APOLBCACNA1F
Trifluoroacetic Acid SCHEMBL8925203 0.81 ALDH1A1 (0.57) KCNH2MEN1KMT2APOLBTOP2A
Trifluoroacetic Acid SCHEMBL7993748 0.77 KCNH2 (0.48) KCNH2MEN1KMT2APOLBCACNA1F
Hydrochloric Acid SCHEMBL8923847 0.77 MEN1 (0.58) KCNH2MEN1KMT2APOLBCACNA1F
Trifluoroacetic Acid SCHEMBL7846826 0.77 ADRB2 (0.40) KCNH2TOP2ATOP2BCHRM2ALDH1A1
Hydrochloric Acid SCHEMBL7842261 0.76 KCNH2 (0.43) KCNH2MEN1KMT2APOLBCACNA1F
Trifluoroacetic Acid SCHEMBL7841876 0.76 KCNH2 (0.61) KCNH2MEN1KMT2APOLBALDH1A1
Hydrochloric Acid SCHEMBL8925488 0.76 KCNH2 (0.59) KCNH2MEN1KMT2APOLBCACNA1F

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010036941-A1 Use of 7-(1-aminomethyl-2-oxa-7-aza-bicyclo[3.3.0]oct-7-yl)-quinolonecarboxylic acid and -naphthyridonecarboxylic acid derivatives for the therapy of Helicobacter pylori infections and associated gastroduodenal disorders PETERSEN UWE (DE) 2001-11-01 US disclosed
US-6288081-B1 Use of 7-(1-aminomethyl-2-oxa-7-aza-bicyclo[3.3.0]oct-7-yl)-quinolone carboxylic acid and naphthyridone carboxylic acid derivatives for treating Helicobacter pylori infections and the gastroduodenal diseases associated therewith BAYER AKTIENGESELLSCHAFT (DE) 2001-09-11 US 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-20010036941-A1 Use of 7-(1-aminomethyl-2-oxa-7-aza-bicyclo[3.3.0]oct-7-yl)-quinolonecarboxylic acid and -naphthyridonecarboxylic acid derivatives for the therapy of Helicobacter pylori infections and associated gastroduodenal disorders OXER1, AOC3, PAM KCNH2 3936/4885MEN1 4061/4885KMT2A 3320/4885

“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.