Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7318294

CNC(=O)Cn1cc(CCN)c2cc(-c3cccc4ccccc34)ccc21.O=C(O)C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NTSR1 P30989 5/20 0.45
ICMT O60725 9/20 0.40
MCL1 Q07820 2/20 0.40
AKR1A1 P14550 1/20 0.38
AKR1B1 P15121 1/20 0.38
HTR6 P50406 1/20 0.37
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36

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 SCHEMBL7307478 0.77 ICMT (0.52) ICMT
Hydrochloric Acid SCHEMBL7307947 0.75 F10 (0.48) ICMT
Trifluoroacetic Acid SCHEMBL7544964 0.75 MTNR1A (0.38) NTSR1MCL1CYP2C9CYP2C19PPARG
Hydrochloric Acid SCHEMBL7308593 0.73 F10 (0.52) ICMT
SCHEMBL10769439 0.72 HTR7 (0.46)
Hydrochloric Acid SCHEMBL7314502 0.72 ICMT (0.52) ICMTPPARG
Trifluoroacetic Acid SCHEMBL7319779 0.72 HTR6 (0.55) MCL1HTR6
SCHEMBL7318525 0.72 NTSR1 (0.38) NTSR1ICMTMCL1HTR6PPARG
SCHEMBL24144266 0.70 NR1D1 (0.52) NTSR1ICMT
SCHEMBL7320265 0.70 ICMT (0.45) ICMTMCL1HTR6PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US claimed
WO-2001034146-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2001-05-17 WO claimed
US-20020004198-A1 Novel anti-infectives SMITHKLINE BEECHAM CORPORATION 2002-01-10 US disclosed
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US disclosed
WO-2001034146-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2001-05-17 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-20010007877-A1 NOVEL ANTI-INFECTIVES CTSL, MMP8, SERPINB1 NTSR1 3750/4885ICMT 1459/4885MCL1 696/4885

“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.