Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4772660

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1ccc2cc[nH]c2c1.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.50
SLC2A1 P11166 2/20 0.48
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
F10 P00742 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
CHRNA7 P36544 2/20 0.43
TRPV1 Q8NER1 1/20 0.42
PLAU P00749 1/20 0.42
NPC1 O15118 2/20 0.41
TP53 P04637 2/20 0.41
NFKB1 P19838 2/20 0.41
RAB9A P51151 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTR3A P46098 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 SCHEMBL4768268 0.94 SLC2A1 (0.47) ESR1SLC2A1MAPTHRH3CHRNA7
SCHEMBL4768483 0.94 ALDH1A1 (0.51) ESR1KDM4EALDH1A1MAPTHPGD
SCHEMBL4768412 0.87 MAOA (0.53) ESR1MAPTHRH3CHRNA7PLAU
Trifluoroacetic Acid SCHEMBL4767916 0.86 TMPRSS2 (0.55) SLC2A1MAPTHRH3TRPV1PLAU
Trifluoroacetic Acid SCHEMBL4774281 0.84 SLC2A1 (0.58) SLC2A1ALDH1A1MAPTHRH3TRPV1
Trifluoroacetic Acid SCHEMBL4767622 0.83 HRH3 (0.51) SLC2A1HRH3TRPV1PLAUNPC1
Trifluoroacetic Acid SCHEMBL4770823 0.82 SLC2A1 (0.47) SLC2A1ALDH1A1MAPTHRH3TRPV1
Trifluoroacetic Acid SCHEMBL4775559 0.81 SLC2A1 (0.47) SLC2A1KDM4EALDH1A1MAPTHRH3
Trifluoroacetic Acid SCHEMBL4765505 0.81 SLC2A1 (0.50) SLC2A1MAPTHRH3TRPV1NPC1
Trifluoroacetic Acid SCHEMBL4775284 0.81 NPC1 (0.52) SLC2A1ALDH1A1MAPTHPGDNPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP claimed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US claimed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP 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-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists HRH3, HRH4, HRH1 ESR1 2997/4885SLC2A1 4665/4885KDM4E 488/4885

“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.