Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4527157

Cc1cccc(-c2cccc(Nc3cc(C)nc(N)n3)c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.55
CYP2D6 P10635 1/20 0.55
DNMT1 P26358 5/20 0.47
DNMT3L Q9UJW3 4/20 0.47
DNMT3A Q9Y6K1 4/20 0.47
ABCG2 Q9UNQ0 8/20 0.45
ABCC1 P33527 5/20 0.45
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
EHMT1 Q9H9B1 2/20 0.43
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
ABCB1 P08183 3/20 0.42
ATR Q13535 1/20 0.42
POLB P06746 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
Trifluoroacetic Acid SCHEMBL4531881 0.90 ABCG2 (0.55) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
Trifluoroacetic Acid SCHEMBL4529644 0.88 CYP1A2 (0.52) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL13963127 0.88 CYP1A2 (0.66) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL13963121 0.82 CYP1A2 (0.77) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL4531885 0.82 CYP1A2 (0.49) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL20355745 0.80 CYP1A2 (0.73) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL13963133 0.80 CYP1A2 (0.58) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL13963137 0.80 CYP1A2 (0.64) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
Hydrochloric Acid SCHEMBL4533038 0.79 CYP1A2 (0.57) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A
SCHEMBL13963126 0.79 CYP1A2 (0.57) CYP1A2CYP2D6DNMT1DNMT3LDNMT3A

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-20090018150-A1 5-Ht2b Receptor Antagonists ASTERAND UK LIMITED (GB) 2009-01-15 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-20090018150-A1 5-Ht2b Receptor Antagonists HTR2B, HTR1B, HTR3B CYP1A2 482/4885CYP2D6 520/4885DNMT1 4671/4885

“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.