Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4911971

CN(C)CCC(Oc1ccc(C(F)(F)F)cc1)c1ccc(CN2CCN(C3CCCC3)CC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.52
HRH3 Q9Y5N1 4/20 0.52
SLC6A9 P48067 10/20 0.47
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
UTS2R Q9UKP6 1/20 0.42
HTR1A P08908 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
KCNH2 Q12809 1/20 0.42

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
SCHEMBL4732396 0.94 SLC6A4 (0.58) SLC6A4HRH3SLC6A9HTR1A
SCHEMBL4919787 0.93 SLC6A4 (0.59) SLC6A4HRH3SLC6A9
Trifluoroacetic Acid SCHEMBL4925697 0.87 SLC6A4 (0.70) SLC6A4HRH3SLC6A9UTS2R
Trifluoroacetic Acid SCHEMBL4924285 0.86 SLC6A4 (0.69) SLC6A4HRH3SLC6A9PPARDPPARA
Trifluoroacetic Acid SCHEMBL4916562 0.85 HRH3 (0.58) SLC6A4HRH3SLC6A9PPARDPPARA
Trifluoroacetic Acid SCHEMBL4919069 0.85 SLC6A4 (0.60) SLC6A4HRH3SLC6A9HTR1A
SCHEMBL4736298 0.83 SLC6A4 (0.55) SLC6A4HRH3
SCHEMBL4921696 0.83 SLC6A4 (0.75) SLC6A4HRH3SLC6A9UTS2R
SCHEMBL4921656 0.82 SLC6A4 (0.73) SLC6A4HRH3SLC6A9UTS2R
SCHEMBL4784335 0.80 SLC6A4 (0.69) SLC6A4HRH3SLC6A9HTR1A

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-20080139564-A1 SUBSTITUTED PHENYL PROPYL AMINES AS HISTAMINE H3 RECEPTOR AND SEROTONIN TRANSPORTER MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-06-12 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-20080139564-A1 SUBSTITUTED PHENYL PROPYL AMINES AS HISTAMINE H3 RECEPTOR AND SEROTONIN TRANSPORTER MODULATORS HRH3, SLC6A4, HNMT SLC6A4 2/4885HRH3 1/4885SLC6A9 97/4885

“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.