Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5211772

COc1cccc2sc(C(N)=O)nc12.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TRPC6 Q9Y210 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
NFKB1 P19838 1/20 0.38
RAB9A P51151 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
F2 P00734 3/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
MITF O75030 1/20 0.35
IDE P14735 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CCR6 P51684 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
Trifluoroacetic Acid SCHEMBL5205875 0.91 RAD52 (0.40) RAD52MEN1KMT2ATP53F2
Trifluoroacetic Acid SCHEMBL5208806 0.91 MAPT (0.37) MEN1KMT2ANPC1TP53HPGD
Trifluoroacetic Acid SCHEMBL5204087 0.89 LMNA (0.37) MEN1KMT2ATP53F2LMNA
Trifluoroacetic Acid SCHEMBL5207641 0.89 RAD52 (0.42) RAD52SMN1; SMN2TP53HPGDF2
Trifluoroacetic Acid SCHEMBL5211180 0.87 NPC1 (0.39) SMN1; SMN2NPC1TP53HPGDRAB9A
Trifluoroacetic Acid SCHEMBL6995379 0.87 TP53 (0.39) RAD52MEN1KMT2ANPC1TP53
Trifluoroacetic Acid SCHEMBL5207907 0.86 MAPT (0.43) MEN1KMT2ANPC1TP53RAB9A
Trifluoroacetic Acid SCHEMBL7432339 0.86 LMNA (0.37) MEN1KMT2ANPC1TP53HPGD
Trifluoroacetic Acid SCHEMBL5210737 0.84 F2 (0.38) MEN1KMT2AF2MAPT
Trifluoroacetic Acid SCHEMBL6999399 0.84 RAD52 (0.41) RAD52SMN1; SMN2NPC1TP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343561-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed
US-7157585-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2007-01-02 US disclosed
US-20050215587-A1 Serine protease inhibitors LIVELY SARAH E 2005-09-29 US disclosed
US-6916957-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2005-07-12 US disclosed
EP-1343561-A1 SERINE PROTEASE INHIBITORS Tularik Limited (GB) 2003-09-17 EP disclosed
US-20030018059-A1 Serine protease inhibitors PROTHERICS MOLECULAR DESIGN LIMITED (GB) 2003-01-23 US disclosed
EP-1240154-A1 SERINE PROTEASE INHIBITORS Tularik Limited (GB) 2002-09-18 EP disclosed
WO-2002047762-A1 SERINE PROTEASE INHIBITORS TULARIK LIMITED (GB) 2002-06-20 WO disclosed
WO-2001044226-A1 SERINE PROTEASE INHIBITORS TULARIK LIMITED (GB) 2001-06-21 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 (2 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-20050215587-A1 Serine protease inhibitors PRSS1, TPSAB1, CMA1 RAD52 3856/4885MEN1 2767/4885KMT2A 2346/4885
US-20030018059-A1 Serine protease inhibitors TPSAB1, PRSS1, SERPINB1 RAD52 4503/4885MEN1 2794/4885KMT2A 3553/4885

“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.