Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5066248

Nc1nonc1-c1nc2c(-c3cccc(Cl)c3)ncc(C(=O)NCCNCc3ccccc3)c2n1CC1CC1.O=C(O)C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.45
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 3/20 0.38
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 1/20 0.36
ROCK1 Q13464 3/20 0.36
PRKACA P17612 1/20 0.36
RPS6KB1 P23443 1/20 0.36
GSK3B P49841 1/20 0.36
THRB P10828 2/20 0.36
AKT1 P31749 3/20 0.36
RPS6KA5 O75582 2/20 0.36
AKT2 P31751 2/20 0.36
AKT3 Q9Y243 2/20 0.36
CTSG P08311 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
SCHEMBL4065699 0.96 KDM4E (0.41) SLC2A1KDM4EKMT2AMAPK1ROCK1
SCHEMBL5597324 0.88 KDM4E (0.39) KDM4EKMT2AMAPK1TP53MAPT
SCHEMBL4070786 0.83 SLC2A1 (0.39) SLC2A1MAPK1ROCK1PRKACARPS6KB1
Trifluoroacetic Acid SCHEMBL5063614 0.78 AKT1 (0.54) SLC2A1ROCK1PRKACARPS6KB1GSK3B
SCHEMBL4067994 0.77 AKT1 (0.50) SLC2A1KDM4EKMT2AROCK1THRB
SCHEMBL4072215 0.76 SLC2A1 (0.56) SLC2A1ROCK1PRKACARPS6KB1GSK3B
Trifluoroacetic Acid SCHEMBL4252172 0.75 SLC2A1 (0.73) SLC2A1ROCK1PRKACAGSK3BAKT1
Trifluoroacetic Acid SCHEMBL5062962 0.75 SLC2A1 (0.62) SLC2A1ATMROCK1PRKACAGSK3B
SCHEMBL5066259 0.75 KDM4E (0.38) KDM4EKMT2AMAPK1THRBTP53
Trifluoroacetic Acid SCHEMBL5062992 0.74 AKT1 (0.43) SLC2A1ATMROCK1AKT1RPS6KA5

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-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 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-20080255143-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 SLC2A1 3039/4885KDM4E 2078/4885KMT2A 1852/4885

“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.