Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1798729

O=C(O)C(F)(F)F.O=C(c1ccc(OCCCCOc2ccccc2)cc1)N1CCC[C@H]1CN1CCCC1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.54
HRH3 Q9Y5N1 3/20 0.51
MET P08581 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 1/20 0.49
ATR Q13535 1/20 0.49
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
SPHK2 Q9NRA0 1/20 0.48
HRH4 Q9H3N8 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HCRTR1 O43613 2/20 0.47
HCRTR2 O43614 2/20 0.47
POLB P06746 1/20 0.47

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 SCHEMBL1798727 1.00 ALK (0.54) ALKHRH3METL3MBTL1MAPT
Trifluoroacetic Acid SCHEMBL1800258 0.98 ALK (0.54) ALKHRH3METL3MBTL1MAPT
Trifluoroacetic Acid SCHEMBL1800256 0.98 ALK (0.54) ALKHRH3METL3MBTL1MAPT
SCHEMBL1799080 0.94 HRH3 (0.56) HRH3METL3MBTL1MAPTKDM4E
SCHEMBL1799082 0.94 HRH3 (0.56) HRH3METL3MBTL1MAPTKDM4E
Trifluoroacetic Acid SCHEMBL1795597 0.93 ALK (0.49) ALKHRH3METL3MBTL1MAPT
Trifluoroacetic Acid SCHEMBL1795599 0.93 ALK (0.49) ALKHRH3METL3MBTL1MAPT
SCHEMBL12616094 0.92 HRH3 (0.56) HRH3METL3MBTL1MAPTATR
SCHEMBL12615763 0.92 HRH3 (0.56) HRH3METL3MBTL1MAPTATR
SCHEMBL1799463 0.91 HRH3 (0.57) HRH3METL3MBTL1MAPTATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1861360-B1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2009-12-02 EP claimed
EP-1861360-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-12-05 EP claimed
WO-2006101808-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-09-28 WO claimed
US-7951826-B2 Obesity; cognition activators; narcolepsy ELI LILLY AND COMPANY (US) 2011-05-31 US disclosed
EP-1861360-B1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2009-12-02 EP disclosed
US-20080207732-A1 Pyrrolidine Derivatives as Histamine H3 Receptor Antagonists ELI LILLY AND COMPANY 2008-08-28 US disclosed
EP-1861360-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-12-05 EP disclosed
WO-2006101808-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-09-28 WO 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-20080207732-A1 Pyrrolidine Derivatives as Histamine H3 Receptor Antagonists HRH3, HCRTR1, HRH4 ALK 889/4885HRH3 1/4885MET 1108/4885

“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.