Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2681709

CC(C)NC(=O)c1ccc2nc(-c3cc(-c4cnn(C)c4)cnc3N)[nH]c2c1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.51
MAP4K4 O95819 2/20 0.47
SLC2A1 P11166 2/20 0.46
MAPK1 P28482 4/20 0.43
NPBWR1 P48145 1/20 0.43
MINK1 Q8N4C8 1/20 0.42
TNIK Q9UKE5 1/20 0.42
CSF1R P07333 3/20 0.41
ABL1 P00519 1/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
YES1 P07947 1/20 0.41
LYN P07948 1/20 0.41
HCK P08631 1/20 0.41
FGR P09769 1/20 0.41
SRC P12931 1/20 0.41
CSK P41240 1/20 0.41
BLK P51451 1/20 0.41
BMX P51813 1/20 0.41
SRMS Q9H3Y6 1/20 0.41

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
SCHEMBL2682252 0.94 SLC2A1 (0.51) METMAP4K4SLC2A1MAPK1MINK1
Trifluoroacetic Acid SCHEMBL1078545 0.89 SLC2A1 (0.50) METMAP4K4SLC2A1MAPK1NPBWR1
SCHEMBL2681943 0.84 MAP4K4 (0.62) METMAP4K4SLC2A1MAPK1NPBWR1
SCHEMBL2680251 0.83 MAP4K4 (0.52) METMAP4K4SLC2A1MAPK1NPBWR1
Trifluoroacetic Acid SCHEMBL2681122 0.83 MET (0.49) METMAP4K4MAPK1YES1
SCHEMBL1078643 0.82 SLC2A1 (0.55) METMAP4K4SLC2A1MAPK1NPBWR1
Trifluoroacetic Acid SCHEMBL1043431 0.81 MET (0.48) METMAP4K4MAPK1YES1
Trifluoroacetic Acid SCHEMBL1045539 0.81 MET (0.51) METMAP4K4SLC2A1MAPK1NPBWR1
SCHEMBL4258499 0.81 MAP4K4 (0.53) METMAP4K4MAPK1ABL1PDPK1
SCHEMBL2680839 0.80 CDK2 (0.62) METMAP4K4SLC2A1NPBWR1PDPK1

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
US-8648201-B2 Aminopyridine derivatives for treating tumors and inflammatory diseases MERCK PATENT GMBH (DE) 2014-02-11 US disclosed
US-20120115861-A1 AMINOPYRIDINE DERIVATIVES FOR TREATING TUMORS AND INFLAMMATORY DISEASES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-05-10 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-20120115861-A1 AMINOPYRIDINE DERIVATIVES FOR TREATING TUMORS AND INFLAMMATORY DISEASES PDK1, PDK2, PDK4 MET 3052/4885MAP4K4 145/4885SLC2A1 890/4885

“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.