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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6530082

CC(=O)NC[C@H]1CN(c2ccc(N3CCN(CN)CC3)c(F)c2)C(=O)O1.O=C(O)C(F)(F)F

nearest known ligand 0.70

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 5/20 0.70
▸ MAOB P27338 5/20 0.70
▸ PTGS1 P23219 2/20 0.70
▸ SDHA P31040 2/20 0.70
▸ LMNA P02545 1/20 0.70
▸ CALML3 P27482 1/20 0.70
▸ F10 P00742 10/20 0.55

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
SCHEMBL5571685 0.89 MAOB (0.76) MAOAMAOBPTGS1SDHALMNA
Trifluoroacetic Acid SCHEMBL5943313 0.88 MAOB (0.73) MAOAMAOBPTGS1SDHALMNA
Trifluoroacetic Acid SCHEMBL6509850 0.88 MAOB (0.73) MAOAMAOBPTGS1SDHALMNA
Trifluoroacetic Acid SCHEMBL5727900 0.88 MAOB (0.73) MAOAMAOBPTGS1SDHALMNA
SCHEMBL14611816 0.87 MAOB (0.79) MAOAMAOBPTGS1SDHALMNA
SCHEMBL27921352 0.85 MAOB (0.76) MAOAMAOBPTGS1SDHALMNA
SCHEMBL1956748 0.85 MAOB (0.82) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6614867 0.85 MAOB (0.79) MAOAMAOBPTGS1SDHALMNA
SCHEMBL1953314 0.85 MAOB (0.82) MAOAMAOBPTGS1SDHALMNA
SCHEMBL1894511 0.85 MAOB (0.79) MAOAMAOBPTGS1SDHALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005082899-A1 OXAZOLIDINONE DERIVATIVES AS ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2005-09-09 — — WO disclosed