Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL737615

O=C(O)C(F)(F)F.O=CC1CCN(c2ccc(OCCCN3CCCCC3)cc2)CC1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.58
KCNH2 Q12809 2/20 0.58
MAOB P27338 1/20 0.51
MAPT P10636 2/20 0.50
POLB P06746 1/20 0.50
CACNA1B Q00975 2/20 0.49
ALDH1A1 P00352 3/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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 SCHEMBL737246 0.83 HRH3 (0.67) HRH3KCNH2MAOBCACNA1BALDH1A1
SCHEMBL737616 0.80 HRH3 (0.58) HRH3KCNH2MAOBMAPTPOLB
Trifluoroacetic Acid SCHEMBL735635 0.79 HRH3 (0.57) HRH3KCNH2MAPTPOLBCACNA1B
Trifluoroacetic Acid SCHEMBL3573078 0.78 HRH1 (0.58) HRH3KCNH2MAPTALDH1A1GAA
Trifluoroacetic Acid SCHEMBL738381 0.77 HRH3 (0.61) HRH3KCNH2ALDH1A1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL736519 0.77 HRH3 (0.55) HRH3KCNH2MAPTPOLBCACNA1B
Trifluoroacetic Acid SCHEMBL737443 0.77 HRH3 (0.60) HRH3KCNH2MAPTPOLBCACNA1B
SCHEMBL6472573 0.76 HRH3 (0.72) HRH3KCNH2MAPTPOLBALDH1A1
Trifluoroacetic Acid SCHEMBL738424 0.75 HRH3 (0.52) HRH3KCNH2CACNA1BALDH1A1GAA
Trifluoroacetic Acid SCHEMBL3576594 0.75 HRH3 (0.53) HRH3KCNH2MAPTCACNA1BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 US claimed
US-8138206-B2 Piperidine derivative MSD. K.K. (JP) 2012-03-20 US disclosed
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 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-20090137576-A1 Novel Piperidine Derivative HRH4, HRH3, HRH1 HRH3 2/4885KCNH2 308/4885MAOB 1314/4885

“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.