Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5618525

C1CN(C2CC2)CCN1.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PKM P14618 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
CHRNB3 Q05901 1/20 0.38
CHRNA6 Q15825 1/20 0.38
HTR6 P50406 1/20 0.37
L3MBTL3 Q96JM7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
GABRA1 P14867 1/20 0.34
TSHR P16473 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34

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 SCHEMBL29823097 0.94 HPGD (0.40) HPGDKMT2ASMN1; SMN2PKMCHRNB2
Trifluoroacetic Acid SCHEMBL4071422 0.93 HTR6 (0.43) HPGDKMT2ASMN1; SMN2PKMCHRNB2
Trifluoroacetic Acid SCHEMBL1018462 0.93 HTR6 (0.43) HPGDKMT2ASMN1; SMN2PKMCHRNB2
Trifluoroacetic Acid SCHEMBL3963270 0.88 HTR6 (0.43) KMT2AHTR6L3MBTL3L3MBTL1HRH3
Trifluoroacetic Acid SCHEMBL21816712 0.88 HRH3 (0.39) HPGDKMT2ASMN1; SMN2HRH3
Trifluoroacetic Acid SCHEMBL1546542 0.85 L3MBTL3 (0.39) HPGDKMT2ASMN1; SMN2PKMCHRNB2
Trifluoroacetic Acid SCHEMBL7330887 0.84 KMT2A (0.74) HPGDKMT2ASMN1; SMN2KDM4EALDH1A1
Trifluoroacetic Acid SCHEMBL20236674 0.84 PKM (0.36) HPGDKMT2ASMN1; SMN2PKMCHRNB2
Trifluoroacetic Acid SCHEMBL17262311 0.84 PKM (0.36) HPGDKMT2ASMN1; SMN2PKMCHRNB2
Trifluoroacetic Acid SCHEMBL22587649 0.83 ALDH1A1 (0.46) HPGDKMT2ASMN1; SMN2PKMHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276509-B2 Piperidine derivatives and their use as antagonists of tachykinins GLAXO GROUP LIMITED (GB) 2007-10-02 US disclosed
US-20050096313-A1 Piperidine derivatives and their use as antagonists of tachykinins GLAXO GROUP LIMITED (GB) 2005-05-05 US disclosed
EP-1472243-A1 PIPERIDINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF TACHYKININS GLAXO GROUP LIMITED (GB) 2004-11-03 EP disclosed
WO-2003066621-A1 PIPERIDINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF TACHYKININS GLAXO GROUP LIMITED (GB) 2003-08-14 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-20050096313-A1 Piperidine derivatives and their use as antagonists of tachykinins NPSR1, TACR1, OPRL1 HPGD 1802/4885KMT2A 2924/4885SMN1; SMN2 4092/4885

“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.