Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29971002

CN1CCC[C@@H]1C(=O)NC1(Cc2ccccn2)CCNCC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.47
HSD11B1 P28845 1/20 0.43
ELANE P08246 2/20 0.39
CHRM3 P20309 3/20 0.37
GPR6 P46095 1/20 0.37
F2 P00734 1/20 0.37
PRSS1 P07477 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH4 Q9H3N8 3/20 0.35
HRH3 Q9Y5N1 2/20 0.35
FKBP1A P62942 1/20 0.35
CPB2 Q96IY4 1/20 0.35

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 SCHEMBL20137739 1.00 RET (0.47) RETHSD11B1ELANECHRM3GPR6
SCHEMBL28675550 0.94 RET (0.51) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL20070064 0.94 RET (0.51) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL22856984 0.84 RET (0.54) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL20137709 0.83 RET (0.52) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL20137706 0.83 RET (0.52) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL20069617 0.83 RET (0.53) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL21651952 0.83 RET (0.51) RETHSD11B1ELANEALDH1A1LMNA
SCHEMBL25502425 0.83 RET (0.51) RETHSD11B1ALDH1A1LMNAGLA
SCHEMBL20068813 0.81 RET (0.46) RETHSD11B1ALDH1A1PKMHTT

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-20220313676-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA, INC. 2022-10-06 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-20220313676-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885HSD11B1 2886/4885ELANE 3233/4885

“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.