Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4339706

O=C(NC1CCC(F)(F)CC1)c1nc(-c2ccc(F)cc2)c2ccccn12.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.42
HTR4 Q13639 7/20 0.42
CNR1 P21554 4/20 0.41
CYP3A4 P08684 3/20 0.40
CYP2D6 P10635 2/20 0.40
PPARG P37231 1/20 0.40
CNR2 P34972 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
MAP2K3 P46734 1/20 0.39

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
SCHEMBL13578195 0.94 CNR1 (0.45) RORCHTR4CNR1CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL4325507 0.91 MAP2K3 (0.50) RORCHTR4CNR1CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL4339713 0.88 CSNK1D (0.46) RORCHTR4CNR1PPARG
Trifluoroacetic Acid SCHEMBL4329769 0.86 ATM (0.44) RORCHTR4CNR1CYP3A4CYP2D6
Trifluoroacetic Acid SCHEMBL4336494 0.86 RORC (0.44) RORCHTR4CNR1PPARGMAP2K3
SCHEMBL13578149 0.85 MAP2K3 (0.56) HTR4CNR1CYP3A4CYP2D6MAP2K3
Trifluoroacetic Acid SCHEMBL4326422 0.84 L3MBTL1 (0.42) RORCHTR4PPARGMAP2K3
Trifluoroacetic Acid SCHEMBL4325959 0.84 HTR4 (0.43) HTR4CNR1CYP3A4CYP2D6CNR2
Trifluoroacetic Acid SCHEMBL4331249 0.83 GABRA5 (0.40) RORCHTR4CNR1CYP3A4CYP2D6
SCHEMBL4324377 0.83 MAP2K3 (0.44) RORCHTR4CNR1CYP3A4CYP2D6

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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES MERCK & CO., INC. 2009-12-31 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-20090325936-A1 IMIDAZOPYRIDINE ANALOGS AS CB2 RECEPTOR MODULATORS, USEFUL IN THE TREATMENT OF PAIN, RESPIRATORY AND NON-RESPIRATORY DISEASES CNR2, CNR1, TRPV1 RORC 135/4885HTR4 254/4885CNR1 2/4885

“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.