Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6800741

O=C(CCCN1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1)c1ccc2c(c1)CCNCC2.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.54
TSHR P16473 1/20 0.47
DRD2 P14416 8/20 0.46
DRD3 P35462 5/20 0.46
DRD4 P21917 4/20 0.46
CYP2D6 P10635 1/20 0.44
HTR2A P28223 3/20 0.44
HTR7 P34969 3/20 0.44
ACHE P22303 1/20 0.44
HTR1A P08908 2/20 0.43
HRH1 P35367 1/20 0.43
HTR2B P41595 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
HTR2C P28335 1/20 0.42
SLC18A3 Q16572 1/20 0.42
SIGMAR1 Q99720 1/20 0.42

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
SCHEMBL5578259 0.95 MCHR1 (0.57) MCHR1TSHRDRD2DRD3DRD4
Hydrochloric Acid SCHEMBL5578288 0.94 MCHR1 (0.56) MCHR1TSHRDRD2DRD3DRD4
Trifluoroacetic Acid SCHEMBL6803243 0.90 MCHR1 (0.59) MCHR1DRD2DRD3HTR2AHTR7
SCHEMBL5578077 0.87 MCHR1 (0.67) MCHR1DRD2DRD3DRD4HTR2A
Trifluoroacetic Acid SCHEMBL6807224 0.86 ACHE (0.57) MCHR1TSHRDRD2DRD3DRD4
Hydrochloric Acid SCHEMBL5578192 0.86 MCHR1 (0.66) MCHR1DRD2DRD3DRD4HTR2A
Trifluoroacetic Acid SCHEMBL6803247 0.84 MCHR1 (0.59) MCHR1TSHRDRD2DRD3DRD4
SCHEMBL7065256 0.84 TSHR (0.48) MCHR1TSHRDRD2DRD3DRD4
Trifluoroacetic Acid SCHEMBL6799364 0.84 MCHR1 (0.51) MCHR1TSHRDRD2DRD3DRD4
Trifluoroacetic Acid SCHEMBL6807608 0.83 MCHR1 (0.62) MCHR1TSHRDRD2DRD3DRD4

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-20040063699-A1 Gpr14 antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1310490-A1 GPR14 ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-05-14 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-20040063699-A1 Gpr14 antagonist GPR142, GPR139, GPR4 MCHR1 191/4885TSHR 1026/4885DRD2 329/4885

“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.