Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29675745

O=C(O)C(F)(F)F.c1ccc(-c2cnc(-c3cc(-c4cnn(CCN5CCOCC5)c4)ccn3)[nH]2)cc1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 1/20 0.41
TBK1 Q9UHD2 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
PIK3CD O00329 2/20 0.41
PIK3CA P42336 2/20 0.41
PIK3CB P42338 2/20 0.41
PIK3CG P48736 2/20 0.41
PIK3R2 O00459 1/20 0.41
PIK3R5 Q8WYR1 1/20 0.41
PIK3R3 Q92569 1/20 0.41
ABL1 P00519 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
MET P08581 1/20 0.40
MAPK1 P28482 3/20 0.40
WDR5 P61964 1/20 0.39
APAF1 O14727 1/20 0.38
MITF O75030 1/20 0.38
CASP7 P55210 1/20 0.38

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 SCHEMBL19065400 1.00 IKBKE (0.41) IKBKETBK1CNR1CNR2PIK3CD
SCHEMBL19065674 0.92 MAPK1 (0.44) IKBKETBK1CNR1CNR2PIK3CD
Trifluoroacetic Acid SCHEMBL19065481 0.89 CCNC (0.42) CNR1CNR2METBTK
Trifluoroacetic Acid SCHEMBL29675555 0.89 CCNC (0.42) CNR1CNR2METBTK
Trifluoroacetic Acid SCHEMBL29676048 0.86 PDK2 (0.49) METPDK2
Trifluoroacetic Acid SCHEMBL19065513 0.86 PDK2 (0.49) METPDK2
Trifluoroacetic Acid SCHEMBL19065478 0.86 NPY5R (0.41) METPDK2
Trifluoroacetic Acid SCHEMBL29675379 0.86 NPY5R (0.41) METPDK2
Trifluoroacetic Acid SCHEMBL19065605 0.84 NPY5R (0.42) METPDK2
Trifluoroacetic Acid SCHEMBL29675408 0.84 NPY5R (0.42) METPDK2

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-3792256-B1 PYRIDINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORP (US) 2024-10-23 EP disclosed
US-11952367-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors INCYTE CORPORATION (US) 2024-04-09 US disclosed
US-20220227736-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION 2022-07-21 US disclosed
US-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors INCYTE CORPORATION (US) 2022-06-07 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 (3 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-20220227736-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB IKBKE 129/4885TBK1 56/4885CNR1 3010/4885
US-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors PIK3CG, PIK3CD, PIK3CB IKBKE 129/4885TBK1 56/4885CNR1 3010/4885
US-11952367-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors PIK3CG, PIK3CD, PIK3CB IKBKE 129/4885TBK1 56/4885CNR1 3010/4885

“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.