Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4227446

O=C(CN[C@@H]1C[C@@H]2CCCc3cccc1c32)N(c1ccccc1)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
OPRD1 P41143 2/20 0.36
EPHX2 P34913 2/20 0.35
TAS1R3 Q7RTX0 2/20 0.35
TAS1R1 Q7RTX1 2/20 0.35
TAS1R2 Q8TE23 2/20 0.35
TAOK1 Q7L7X3 2/20 0.35
TAOK3 Q9H2K8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
XBP1 P17861 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 SCHEMBL4237167 0.78 MTNR1A (0.39) HTTALDH1A1KMT2AKDM4E
Trifluoroacetic Acid SCHEMBL4226991 0.69 KDM1A (0.56)
Trifluoroacetic Acid SCHEMBL4226583 0.68 MTNR1A (0.53)
SCHEMBL9568030 0.64 ALDH1A1 (0.45) HTTALDH1A1XBP1
Hydrochloric Acid SCHEMBL4235489 0.64 GRIN2B (0.52) MEN1KMT2AKDM4E
SCHEMBL5901234 0.63 HTT (0.61) HTTALDH1A1MEN1KMT2AGAA
Trifluoroacetic Acid SCHEMBL3722524 0.63 HTT (0.47) HTTALDH1A1MEN1KMT2AOPRD1
Trifluoroacetic Acid SCHEMBL18440248 0.63 HTT (0.36) HTT
SCHEMBL3600888 0.62 IDO1 (0.41) TAS1R3TAS1R1TAS1R2
Trifluoroacetic Acid SCHEMBL4380019 0.62 SSTR4 (0.45)

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
EP-2096104-A1 Organic diamines as mGluR7 modulators Novartis AG (CH) 2009-09-02 EP disclosed
US-20080242698-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-02 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-20080242698-A1 Organic Compounds AOC1, OTC, ODC1 HTT 3311/4885ALDH1A1 266/4885MEN1 464/4885

“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.