Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4329931

O=C(NC1(c2ccccc2)CC1)c1nc(-c2cccnc2)n2ccccc12.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.49
CD38 P28907 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDE2A O00408 5/20 0.37
RAD51 Q06609 1/20 0.36
WNT1 P04628 2/20 0.36
TACR3 P29371 2/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
F9 P00740 1/20 0.35
DHODH Q02127 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
SCHEMBL13578301 0.95 DYRK1A (0.52) DYRK1ACD38L3MBTL1POLBHPGD
Trifluoroacetic Acid SCHEMBL4329692 0.91 CD38 (0.42) DYRK1ACD38L3MBTL1POLBHPGD
SCHEMBL4333065 0.87 HPGD (0.46) DYRK1ACD38L3MBTL1POLBHPGD
Trifluoroacetic Acid SCHEMBL4331013 0.87 CNR2 (0.40) DYRK1ACD38L3MBTL1POLBHPGD
Trifluoroacetic Acid SCHEMBL4331242 0.86 L3MBTL1 (0.45) DYRK1ACD38L3MBTL1POLBHPGD
SCHEMBL13578300 0.85 CD38 (0.45) DYRK1ACD38L3MBTL1POLBHPGD
Trifluoroacetic Acid SCHEMBL4327328 0.85 CNR2 (0.40) DYRK1ACD38L3MBTL1POLBHPGD
Trifluoroacetic Acid SCHEMBL4324774 0.84 L3MBTL1 (0.43) CD38L3MBTL1POLBHPGDMAPK1
SCHEMBL13578307 0.82 CNR2 (0.42) DYRK1ACD38L3MBTL1POLBHPGD
Trifluoroacetic Acid SCHEMBL4322093 0.82 MAP3K14 (0.43) DYRK1AL3MBTL1POLBHPGDMAPK1

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 DYRK1A 1478/4885CD38 785/4885L3MBTL1 4825/4885

“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.