Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL19097309

O=C(O)C(F)(F)F.O=CN1CCc2c(C(F)(F)F)nn(Cc3ccc(F)cc3)c2C1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 6/20 0.44
▸ LMNA P02545 3/20 0.41
▸ TSHR P16473 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ IDH1 O75874 1/20 0.40
▸ POLQ O75417 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KCNJ2 P63252 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ AADAT Q8N5Z0 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 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
SCHEMBL19097281 0.94 KCNK3 (0.43) KCNK3LMNATSHRNPSR1POLQ
SCHEMBL17317595 0.82 KCNK3 (0.52) KCNK3LMNATSHRNPSR1IDH1
Trifluoroacetic Acid SCHEMBL17317822 0.81 KCNK3 (0.42) KCNK3LMNATSHRNPSR1IDH1
SCHEMBL17317858 0.78 KCNK3 (0.50) KCNK3LMNATSHRNPSR1TP53
SCHEMBL17317859 0.78 KCNK3 (0.44) KCNK3LMNATSHRNPSR1IDH1
SCHEMBL19123655 0.77 GRIA2 (0.54) KCNK3
Trifluoroacetic Acid SCHEMBL17317621 0.77 KCNK3 (0.46) KCNK3IDH1POLQPOLB
SCHEMBL19097241 0.76 ENPP2 (0.47) KCNK3LMNATSHRNPSR1
SCHEMBL17328080 0.76 ENPP2 (0.47) KCNK3LMNATSHRNPSR1
SCHEMBL17328165 0.76 ENPP2 (0.47) KCNK3LMNATSHRNPSR1

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-20170197960-A1 ATX MODULATING AGENTS BIOGEN MA INC. 2017-07-13 — — 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-20170197960-A1 ATX MODULATING AGENTS ENPP2, ATXN10, ATXN2 KCNK3 1825/4885LMNA 2678/4885TSHR 767/4885

“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.

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