Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4764951

Cn1ncc(C(=O)Nc2ccc3c(c2)CCN(C2CCC2)CC3)n1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.47
SLC2A1 P11166 2/20 0.45
RAB9A P51151 5/20 0.44
HRH1 P35367 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 3/20 0.42
TP53 P04637 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.40
BLM P54132 1/20 0.40

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
SCHEMBL4772665 0.93 HRH3 (0.52) HRH3RAB9AHRH1ALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4768548 0.85 ALDH1A1 (0.64) HRH3SLC2A1RAB9AHRH1ALDH1A1
Trifluoroacetic Acid SCHEMBL4767895 0.82 AURKA (0.50) HRH3SLC2A1RAB9AHRH1NPC1
Trifluoroacetic Acid SCHEMBL4765255 0.82 SLC2A1 (0.43) HRH3SLC2A1RAB9AHRH1ALDH1A1
Trifluoroacetic Acid SCHEMBL4766836 0.82 SLC2A1 (0.44) HRH3SLC2A1RAB9AHRH1ALDH1A1
Trifluoroacetic Acid SCHEMBL4770760 0.82 HRH3 (0.50) HRH3SLC2A1RAB9AHRH1NPC1
Trifluoroacetic Acid SCHEMBL4768481 0.81 NPY5R (0.49) HRH3SLC2A1
SCHEMBL4772484 0.81 NPC1 (0.55) HRH3RAB9AHRH1NPC1TP53
Trifluoroacetic Acid SCHEMBL4770952 0.81 LMNA (0.51) HRH3SLC2A1RAB9AHRH1ALDH1A1
Trifluoroacetic Acid SCHEMBL4775304 0.81 SLC2A1 (0.43) HRH3SLC2A1HRH1ALDH1A1LMNA

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 HRH3 1/4885SLC2A1 4665/4885RAB9A 2307/4885

“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.