Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8466629

Cc1ccc(C=C(N(C)C)[n+]2ccccc2)cc1.O=C([O-])C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.35
NPSR1 Q6W5P4 8/20 0.35
AKR1C3 P42330 1/20 0.33
PTGS2 P35354 1/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
DPP4 P27487 1/20 0.32
DPP9 Q86TI2 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 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
SCHEMBL8462702 0.83 PTGS2 (0.44) TRPM8AKR1C3PTGS2POLBALDH1A1
SCHEMBL2777625 0.77 PTGS2 (0.44) AKR1C3PTGS2MAPTNPC1POLB
SCHEMBL8466771 0.76 PTGS2 (0.44) AKR1C3PTGS2MAPTNPC1POLB
SCHEMBL8607275 0.75 CHAT (0.39) AKR1C3MAPTRAB9AALDH1A1
Hydrochloric Acid SCHEMBL9052839 0.74 CHAT (0.38) AKR1C3MAPTRAB9AALDH1A1
SCHEMBL14948652 0.65 AKR1C3 (0.43) TRPM8AKR1C3MAPTNPC1POLB
Trifluoroacetic Acid SCHEMBL11058670 0.62 CA2 (0.41) NPSR1MAPTNPC1POLBRAB9A
Trifluoroacetic Acid SCHEMBL3555121 0.61 USP2 (0.39) NPSR1
Trifluoroacetic Acid SCHEMBL2262918 0.61 USP2 (0.39) NPSR1
Trifluoroacetic Acid SCHEMBL2160769 0.61 CES1 (0.34) NPSR1

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-0828867-A4 METHOD AND APPARATUS USING ORGANIC VAPOR PHASE DEPOSITION FOR THE GROWTH OF ORGANIC THIN FILMS WITH LARGE OPTICAL NON-LINEARITIES UNIV PRINCETON (US) 1999-10-27 EP disclosed
EP-0828867-A2 METHOD AND APPARATUS USING ORGANIC VAPOR PHASE DEPOSITION FOR THE GROWTH OF ORGANIC THIN FILMS WITH LARGE OPTICAL NON-LINEARITIES THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1998-03-18 EP disclosed
WO-1996037639-A2 METHOD AND APPARATUS USING ORGANIC VAPOR PHASE DEPOSITION FOR THE GROWTH OF ORGANIC THIN FILMS WITH LARGE OPTICAL NON-LINEARITIES THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1996-11-28 WO disclosed