Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5455015

C1=Cc2ccccc2CC=N1.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.33
KDM1A O60341 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
DPP8 Q6V1X1 1/20 0.30
DPP7 Q9UHL4 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL208144 0.83 CA1 (0.40) CA1CA2
Succinic Acid SCHEMBL506729 0.83 NOTUM (0.37) CA1CA2MAOAMAOB
Hydrochloric Acid SCHEMBL506406 0.82 PARP1 (0.39) CA1CA2
Water SCHEMBL16428036 0.82 CA1 (0.43) CA1CA2
Bromide SCHEMBL16698664 0.82 CA1 (0.39) CA1CA2
Water SCHEMBL16428037 0.82 CA1 (0.43) CA1CA2
SCHEMBL27693919 0.82 CA1 (0.39) CA1CA2
Hydrochloric Acid SCHEMBL28783882 0.80 CA1 (0.42) CA1CA2
Trifluoroacetic Acid SCHEMBL25247629 0.74
Trifluoroacetic Acid SCHEMBL31674669 0.71 CES1 (0.37) CES1KDM1ADPP8DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders CNR2, GRIN2C, GRIN2B CES1 842/4885KDM1A 1201/4885CA1 1515/4885

“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.