Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4807459

NC(=O)c1ccc2c(c1)CCC2.NCc1cccc(C(=O)N(CC(=O)O)c2csc(NC=O)n2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.33
MEN1 O00255 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
RAD52 P43351 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
GCGR P47871 1/20 0.30
GIPR P48546 1/20 0.30
ENPP2 Q13822 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
RAB9A P51151 1/20 0.30
TRPC6 Q9Y210 1/20 0.30

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 SCHEMBL6531938 0.93 NPC1 (0.31) MAPK14HPGDSMN1; SMN2L3MBTL1NPC1
Trifluoroacetic Acid SCHEMBL4809541 0.88 MAPT (0.35) MAPK14MEN1HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL4809310 0.88 MEN1 (0.35) MAPK14MEN1HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL4802588 0.87 MEN1 (0.35) MAPK14MEN1HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL4809992 0.86 ENPP2 (0.41) MAPK14MEN1HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL4809932 0.86 MAPK14 (0.35) MAPK14MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL4812018 0.85 NPC1 (0.35) MAPK14MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL4812613 0.84 MAPK14 (0.36) MAPK14MEN1HPGDKMT2ASMN1; SMN2
SCHEMBL4805867 0.83 MAPT (0.38) MAPK14MEN1HPGDKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL4806911 0.83 MEN1 (0.36) MAPK14MEN1HPGDKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7381734-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2008-06-03 US disclosed
US-7157585-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2007-01-02 US disclosed
EP-1294691-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2006-11-08 EP disclosed
US-7074934-B2 An aromatic alkylamino compound containing a lipophilic group useful as antithrombotic agent as well as treats asthma TULARIK LIMITED (GB) 2006-07-11 US disclosed
US-7067516-B2 Serine protease inhibitors TULARIK LIMITED (GB) 2006-06-27 US disclosed
US-20050267173-A1 Serine protease inhibitors LIVELY SARAH E 2005-12-01 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-20040116439-A1 Serine protease inhibitors TULARIK LIMITED (GB) 2004-06-17 US disclosed
US-20030216403-A1 Serine protease inhibitors TULARIK LIMITED (GB) 2003-11-20 US disclosed
US-20030018059-A1 Serine protease inhibitors PROTHERICS MOLECULAR DESIGN LIMITED (GB) 2003-01-23 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 (4 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 MAPK14 3086/4885MEN1 2767/4885HPGD 807/4885
US-20030216403-A1 Serine protease inhibitors SERPINB1, SERPINE1, PRSS1 MAPK14 3700/4885MEN1 2414/4885HPGD 313/4885
US-20030018059-A1 Serine protease inhibitors TPSAB1, PRSS1, SERPINB1 MAPK14 3266/4885MEN1 2794/4885HPGD 1054/4885
US-20050267173-A1 Serine protease inhibitors PRSS1, TPSAB1, CMA1 MAPK14 3086/4885MEN1 2767/4885HPGD 807/4885

“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.