Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3679528

Cc1cccc(CCc2ccc(S(=O)(=O)NC(CC(=O)O)C[N+](C)(C)C)s2)c1.O=C([O-])C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.35
POLB P06746 2/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
NR3C1 P04150 1/20 0.32
PGR P06401 1/20 0.32
NR3C2 P08235 1/20 0.32
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
LOX P28300 1/20 0.31
MMP7 P09237 1/20 0.31

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 SCHEMBL3679525 1.00 AKR1C3 (0.35) AKR1C3POLBKMT2AMAPTLMNA
SCHEMBL13409991 0.93 AKR1C3 (0.39) AKR1C3POLBKMT2AMAPTLMNA
Trifluoroacetic Acid SCHEMBL3689890 0.91 EEF2K (0.35) MAPTLMNAALDH1A1HTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL3689887 0.91 EEF2K (0.35) MAPTLMNAALDH1A1HTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL3684585 0.90 ITGB3 (0.38) KMT2AMAPTLMNAALDH1A1HTT
Trifluoroacetic Acid SCHEMBL3684591 0.90 ITGB3 (0.38) KMT2AMAPTLMNAALDH1A1HTT
SCHEMBL3679526 0.86 ALDH1A1 (0.34) AKR1C3POLBKMT2AMAPTLMNA
Trifluoroacetic Acid SCHEMBL3682804 0.84 MMP2 (0.40)
Trifluoroacetic Acid SCHEMBL3682809 0.84 MMP2 (0.40)
SCHEMBL13409995 0.84 ALDH1A1 (0.39) MAPTLMNAALDH1A1HTTSMN1; SMN2

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-8410150-B2 Inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2013-04-02 US disclosed
US-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK 2010-04-29 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-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 AKR1C3 1114/4885POLB 1534/4885KMT2A 662/4885

“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.