Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3673408

N[C@@H](CC1CCC1)C(O)C(=O)NC1CC1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 12/20 0.47
METAP1 P53582 7/20 0.47
REN P00797 4/20 0.37
CPB2 Q96IY4 2/20 0.36
KMT2A Q03164 1/20 0.35
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 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 SCHEMBL27822265 1.00 METAP2 (0.47) METAP2METAP1RENCPB2KMT2A
SCHEMBL2012212 0.90 METAP2 (0.52) METAP2METAP1RENCPB2KMT2A
SCHEMBL742447 0.90 METAP2 (0.52) METAP2METAP1RENCPB2KMT2A
SCHEMBL842176 0.90 METAP2 (0.52) METAP2METAP1RENCPB2KMT2A
Hydrochloric Acid SCHEMBL744909 0.89 METAP2 (0.51) METAP2METAP1RENCPB2KMT2A
Hydrochloric Acid SCHEMBL14973792 0.84 METAP2 (0.56) METAP2METAP1RENCPB2KMT2A
SCHEMBL7351340 0.84 METAP2 (0.56) METAP2METAP1RENCPB2KMT2A
SCHEMBL10260851 0.84 METAP2 (0.48) METAP2METAP1RENKMT2A
SCHEMBL8135701 0.84 METAP2 (0.48) METAP2METAP1RENKMT2A
Hydrochloric Acid SCHEMBL7361763 0.83 METAP2 (0.54) METAP2METAP1RENCPB2KMT2A

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-8211897-B2 Inhibitors of cathepsin B VIROBAY, INC. (US) 2012-07-03 US disclosed
EP-2237793-A1 INHIBITORS OF CATHEPSIN B Virobay, Inc. (US) 2010-10-13 EP disclosed
WO-2009100225-A1 INHIBITORS OF CATHEPSIN B VIROBAY, INC. (US) 2009-08-13 WO disclosed
US-20090203629-A1 INHIBITORS OF CATHEPSIN B VIROBAY, INC. (US) 2009-08-13 US 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-20090203629-A1 INHIBITORS OF CATHEPSIN B CTSB, CSTB, CTSF METAP2 933/4885METAP1 456/4885REN 668/4885

“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.