Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6465751

N[C@@H](CCc1ccccc1)C(O)c1ncco1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 5/20 0.40
METAP1 P53582 4/20 0.40
CES1 P23141 4/20 0.39
FAAH O00519 3/20 0.39
NCEH1 Q6PIU2 1/20 0.39
ANPEP P15144 3/20 0.35
ERAP1 Q9NZ08 3/20 0.35
ERAP2 Q6P179 2/20 0.35
CTSA P10619 3/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7042177 0.90 METAP2 (0.41) METAP2METAP1CES1FAAHNCEH1
SCHEMBL5431177 0.90 METAP2 (0.41) METAP2METAP1CES1FAAHNCEH1
SCHEMBL5954984 0.90 METAP2 (0.41) METAP2METAP1CES1FAAHNCEH1
SCHEMBL22885996 0.80 LAP3 (0.40) CES1FAAHNCEH1ANPEP
Hydrochloric Acid SCHEMBL6349633 0.79 LAP3 (0.39) CES1FAAHNCEH1ANPEPKMT2A
SCHEMBL13129847 0.74 FAAH (0.44) CES1FAAHNCEH1KMT2A
SCHEMBL6466167 0.71 CES1 (0.46) METAP2METAP1CES1FAAHANPEP
Trifluoroacetic Acid SCHEMBL6466295 0.71 CES1 (0.45) CES1FAAHNCEH1
SCHEMBL6207882 0.70 FAAH (0.49) CES1FAAHNCEH1
Trifluoroacetic Acid SCHEMBL20773618 0.70 CTSA (0.40) CTSA

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
EP-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 US disclosed
EP-1161422-A1 AMINE DERIVATIVES AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2001-12-12 EP disclosed
WO-2000055144-A1 AMINE DERIVATIVES AS PROTEASE INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2000-09-21 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ METAP2 244/4885METAP1 136/4885CES1 272/4885

“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.