Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2934965

COc1cc(C(=O)N(C)C2CCN(C)C2)ccc1Nc1cncc(-c2cc3cc(Cl)ccc3[nH]2)n1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PYGL P06737 1/20 0.42
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
TTK P33981 1/20 0.41
IGF1R P08069 1/20 0.38
PTK2 Q05397 10/20 0.37
MCHR1 Q99705 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
DYRK1A Q13627 3/20 0.35
LRRK2 Q5S007 2/20 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
SCHEMBL2929142 0.95 PYGL (0.46) PYGLCCNA2CDK2TTKIGF1R
Trifluoroacetic Acid SCHEMBL2930408 0.95 TTK (0.43) PYGLCCNA2CDK2TTKIGF1R
Trifluoroacetic Acid SCHEMBL2935933 0.94 CCNA2 (0.42) CCNA2CDK2TTKIGF1RPTK2
Trifluoroacetic Acid SCHEMBL2934774 0.94 TTK (0.42) CCNA2CDK2TTKIGF1RPTK2
Trifluoroacetic Acid SCHEMBL2935410 0.93 CCNA2 (0.42) PYGLCCNA2CDK2TTKIGF1R
Trifluoroacetic Acid SCHEMBL2932629 0.92 TTK (0.43) CCNA2CDK2TTKIGF1RPTK2
Trifluoroacetic Acid SCHEMBL2933525 0.91 CCNA2 (0.40) CCNA2CDK2TTKIGF1RPTK2
SCHEMBL2932839 0.90 TTK (0.46) PYGLCCNA2CDK2TTKIGF1R
Trifluoroacetic Acid SCHEMBL2933549 0.90 TTK (0.44) CCNA2CDK2TTKIGF1RPTK2
SCHEMBL2932957 0.89 TTK (0.45) PYGLCCNA2CDK2TTKIGF1R

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-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 PYGL 495/4885CCNA2 471/4885CDK2 182/4885

“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.