Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3587833

NCCC(N)C(=O)NCc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.52
OPRK1 P41145 3/20 0.51
MMP8 P22894 2/20 0.47
F2 P00734 2/20 0.46
TMPRSS6 Q8IU80 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
KIF11 P52732 1/20 0.45
TACR1 P25103 1/20 0.45

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
SCHEMBL3583374 0.91 MMP2 (0.56) MMP2MMP8CYP1A2CYP2D6CYP2C9
SCHEMBL30120748 0.91 MMP2 (0.56) MMP2MMP8CYP1A2CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL28736783 0.90 MMP2 (0.55) MMP2MMP8CYP1A2CYP2D6CYP2C9
Trifluoroacetic Acid SCHEMBL31151115 0.86 SLC1A1 (0.57) OPRK1MMP8ALDH1A1CYP3A4TSHR
Trifluoroacetic Acid SCHEMBL10424902 0.85 SPHK1 (0.54) MMP2OPRK1ALDH1A1CYP3A4
Trifluoroacetic Acid SCHEMBL7101192 0.84 MMP8 (0.53) OPRK1MMP8F2TMPRSS6ALDH1A1
SCHEMBL9275540 0.82 MMP2 (0.64) MMP2MMP8CYP1A2CYP2D6CYP2C9
SCHEMBL8526418 0.82 MMP2 (0.64) MMP2MMP8CYP1A2CYP2D6CYP2C9
Trifluoroacetic Acid SCHEMBL2396342 0.81 ALDH1A1 (0.56) OPRK1MMP8ALDH1A1CYP3A4
SCHEMBL3907033 0.81 MMP2 (0.71) MMP2MMP8CYP1A2CYP2D6CYP2C9

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
US-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 Wurster, Siegfried (FI) 2010-02-25 US disclosed
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 SSTR1, SSTR4, SSTR3 MMP2 3375/4885OPRK1 878/4885MMP8 4847/4885

“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.