Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL828181

CN(CCN)c1ccc2cc(-c3ccccc3OC(F)(F)F)[nH]c(=O)c2c1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.45
KIT P10721 1/20 0.38
EGFR P00533 1/20 0.36
MGLL Q99685 1/20 0.35
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
MAP2 P11137 1/20 0.34
RORC P51449 2/20 0.34
SCN9A Q15858 4/20 0.33
ABL1 P00519 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.33
TNKS O95271 1/20 0.32
DGAT1 O75907 1/20 0.32

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
SCHEMBL824740 0.95 FFAR1 (0.41) FFAR1KITEGFRMGLLPOLB
SCHEMBL824728 0.87 FFAR1 (0.43) FFAR1KITEGFRMGLLPOLB
SCHEMBL2710616 0.86 FFAR1 (0.43) FFAR1KITEGFRMGLLPOLB
SCHEMBL827610 0.85 FFAR1 (0.44) FFAR1KITEGFRMGLLPOLB
Trifluoroacetic Acid SCHEMBL828018 0.85 TNKS (0.42) KDM4EALDH1A1GLAGAATNKS
SCHEMBL824664 0.81 SUV39H2 (0.39) FFAR1KITEGFRRORCSCN9A
SCHEMBL827412 0.81 FFAR1 (0.46) FFAR1KITEGFRMGLLPOLB
SCHEMBL824929 0.80 FFAR1 (0.45) FFAR1KITEGFRMGLLPOLB
SCHEMBL824722 0.79 NTSR1 (0.42) FFAR1
SCHEMBL824609 0.77 TNKS (0.48) KDM4EGAATNKS

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724262-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-05-02 EP disclosed
US-8143274-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2012-03-27 US disclosed
US-20070185160-A1 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
EP-1724262-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-11-22 EP 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-20070185160-A1 1-(2H)-isoquinolone derivative NR3C2, NR1H4, NR3C1 FFAR1 452/4885KIT 4832/4885EGFR 1929/4885

“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.