Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4591223

Cc1nc(-c2ccc(-c3ccc(N4C[C@@H](CCOC(=O)CN)OC4=O)cc3F)cc2)oc1C.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 6/20 0.45
MAOA P21397 8/20 0.42
MAOB P27338 2/20 0.42
CYP2C19 P33261 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.39

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 SCHEMBL1383450 0.93 CALML3 (0.46) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL12606250 0.88 CALML3 (0.50) CALML3MAOAMAOBCYP2C19CYP3A4
Trifluoroacetic Acid SCHEMBL1557380 0.83 MAOA (0.49) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL1380523 0.82 CALML3 (0.52) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL1380521 0.82 CALML3 (0.52) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL1382205 0.81 CALML3 (0.67) CALML3MAOAMAOBCYP2C19CYP3A4
Trifluoroacetic Acid SCHEMBL4611194 0.81 CALML3 (0.47) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL14884802 0.80 MAOA (0.51) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL1380514 0.79 MAOA (0.65) CALML3MAOAMAOBCYP2C19CYP3A4
Trifluoroacetic Acid SCHEMBL14881310 0.78 MAOA (0.51) CALML3MAOACYP3A4CYP2C9

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-1699784-A4 NOVEL OXAZOLIDINONE DERIVATIVES DONG A PHARM CO LTD (KR) 2008-09-03 EP disclosed
EP-1699784-A1 NOVEL OXAZOLIDINONE DERIVATIVES Dong-A Pharmaceutical Co., Ltd. (KR) 2006-09-13 EP disclosed
WO-2005058886-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG-A PHARM.CO.,LTD. (KR) 2005-06-30 WO disclosed