Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5210467

NC(=O)c1ccc2c(c1)CCCC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.37
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
OPRD1 P41143 8/20 0.36
ADRA2C P18825 1/20 0.35
F10 P00742 1/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
GFER P55789 1/20 0.34
PAX8 Q06710 1/20 0.34
KLF5 Q13887 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FOLH1 Q04609 2/20 0.34
OPRM1 P35372 6/20 0.34
MAPK14 Q16539 1/20 0.34
OPRK1 P41145 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33

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 SCHEMBL5212669 0.96 RXRA (0.37) F2PRSS1PRSS2PRSS3OPRD1
Trifluoroacetic Acid SCHEMBL7426179 0.95 F2 (0.36) F2PRSS1PRSS2PRSS3OPRD1
Trifluoroacetic Acid SCHEMBL5213198 0.95 NPC1 (0.36) F2OPRD1NPC1POLBRAB9A
Trifluoroacetic Acid SCHEMBL5214291 0.93 RXRA (0.35) F2PRSS1PRSS2PRSS3OPRD1
Trifluoroacetic Acid SCHEMBL5212857 0.93 PTGES (0.35) F2PRSS1PRSS2PRSS3NPC1
Trifluoroacetic Acid SCHEMBL5212459 0.93 RXRB (0.40) OPRD1NPC1POLBRAB9AGFER
Trifluoroacetic Acid SCHEMBL4809174 0.93 RXRA (0.37) OPRD1NPC1POLBRAB9AGFER
Trifluoroacetic Acid SCHEMBL5213598 0.92 NPC1 (0.35) F2OPRD1NPC1POLBRAB9A
Trifluoroacetic Acid SCHEMBL5209988 0.92 NPC1 (0.37) OPRD1NPC1POLBRAB9AGFER
Trifluoroacetic Acid SCHEMBL7434467 0.91 OPRD1 (0.36) F2PRSS1PRSS2PRSS3OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240154-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
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-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 F2 69/4885PRSS1 1/4885PRSS2 13/4885
US-20030018059-A1 Serine protease inhibitors TPSAB1, PRSS1, SERPINB1 F2 122/4885PRSS1 2/4885PRSS2 18/4885

“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.