Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6955197

C=CCOC(=O)N1CC[C@@H](N)C1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
DPP4 P27487 11/20 0.35
DPP7 Q9UHL4 10/20 0.35
DPP8 Q6V1X1 3/20 0.35
GPR119 Q8TDV5 1/20 0.34
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
NR1D1 P20393 1/20 0.33
GAA P10253 1/20 0.33
F10 P00742 1/20 0.33
PLG P00747 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
PARP1 P09874 1/20 0.33
CHRM1 P11229 1/20 0.32
DPP9 Q86TI2 1/20 0.32

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
SCHEMBL2932359 0.90 GAA (0.38) LMNAMAPK1RAB9AGPR119NR1D1
SCHEMBL2087756 0.90 GAA (0.38) LMNAMAPK1RAB9AGPR119NR1D1
SCHEMBL1286879 0.82 PARP1 (0.39) LMNAMAPK1RAB9AGPR119NR1D1
SCHEMBL19211629 0.81 GAA (0.44) LMNAMAPK1RAB9AGPR119GAA
Trifluoroacetic Acid SCHEMBL952417 0.76 SMN1; SMN2 (0.58) RAB9ADPP4DPP7
Trifluoroacetic Acid SCHEMBL27848482 0.75 HPGD (0.44) DPP4GPR119
Trifluoroacetic Acid SCHEMBL18497410 0.75 LMNA (0.45) LMNAMAPK1RAB9AGPR119HRH4
SCHEMBL9381172 0.75 SMN1; SMN2 (0.44) LMNAMAPK1RAB9AGPR119NR1D1
SCHEMBL9381176 0.75 SMN1; SMN2 (0.44) LMNAMAPK1RAB9AGPR119NR1D1
SCHEMBL9389295 0.75 SMN1; SMN2 (0.44) LMNAMAPK1RAB9AGPR119NR1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0849269-B9 Vinyl pyrrolidine cephalosporins with basic substituents BASILEA PHARMACEUTICA AG (CH) 2003-03-05 EP disclosed
US-5981519-A Vinyl-pyrrolidinone cephalosporins HOFFMAN-LA ROCHE INC. (US) 1999-11-09 US disclosed
EP-0849269-A1 Vinyl pyrrolidine cephalosporins with basic substituents F. HOFFMANN-LA ROCHE AG (CH) 1998-06-24 EP disclosed