Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1379834

NCC(=O)OC[C@H]1CN(c2ccc(-c3ccc(-n4ccnn4)nc3)c(F)c2)C(=O)O1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 17/20 0.52
CYP3A4 P08684 3/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CALML3 P27482 1/20 0.46

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
SCHEMBL12605351 0.96 MAOA (0.56) MAOACYP3A4CYP2D6CYP2C9CALML3
Trifluoroacetic Acid SCHEMBL14881310 0.93 MAOA (0.51) MAOACYP3A4CYP2D6CYP2C9CALML3
Trifluoroacetic Acid SCHEMBL1380752 0.88 CALML3 (0.49) MAOACYP3A4CYP2C9CALML3
SCHEMBL12606548 0.84 CALML3 (0.53) MAOACYP3A4CYP2C9CALML3
SCHEMBL1380456 0.83 MAOA (0.66) MAOACYP3A4CYP2D6CALML3
SCHEMBL14852816 0.83 MAOA (0.66) MAOACYP3A4CYP2D6CALML3
Trifluoroacetic Acid SCHEMBL4611194 0.81 CALML3 (0.47) MAOACYP3A4CYP2C9CALML3
Trifluoroacetic Acid SCHEMBL15334151 0.81 MAOA (0.44) MAOACYP2C9CALML3
Trifluoroacetic Acid SCHEMBL1380054 0.81 MAOA (0.55) MAOACYP3A4CYP2C9CALML3
Trifluoroacetic Acid SCHEMBL1379425 0.81 MAOA (0.71) MAOACYP3A4CYP2C9CALML3

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4739229-B2 2011-08-03 JP claimed
EP-1699784-A4 NOVEL OXAZOLIDINONE DERIVATIVES DONG A PHARM CO LTD (KR) 2008-09-03 EP claimed
US-20070155798-A1 Antibiotics with improved solubility, lower toxicity; potent antibacterial activity; includes torezolid phosphate DONG-A PHARM. CO., LTD. 2007-07-05 US claimed
EP-1699784-A1 NOVEL OXAZOLIDINONE DERIVATIVES Dong-A Pharmaceutical Co., Ltd. (KR) 2006-09-13 EP claimed
WO-2005058886-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG-A PHARM.CO.,LTD. (KR) 2005-06-30 WO claimed
US-20210121449-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A ST CO LTD (KR) 2021-04-29 US disclosed
US-20200078345-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A ST CO LTD (KR) 2020-03-12 US disclosed
US-20180344716-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A ST CO LTD (KR) 2018-12-06 US disclosed
US-20170333414-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A ST CO LTD (KR) 2017-11-23 US disclosed
US-20170049763-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A ST CO LTD (KR) 2017-02-23 US disclosed
US-9163043-B2 Oxazolidinone derivatives DONG-A ST CO., LTD. (KR) 2015-10-20 US disclosed
US-20140350059-A1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A ST CO LTD (KR) 2014-11-27 US disclosed
EP-1699784-B1 NOVEL OXAZOLIDINONE DERIVATIVES DONG A PHARM CO LTD (KR) 2011-06-29 EP disclosed
EP-2305657-A2 Oxazolidinone derivatives Dong-A Pharmaceutical Co., Ltd. (KR) 2011-04-06 EP disclosed
US-7816379-B2 Antibiotics with improved solubility, lower toxicity; potent antibacterial activity; includes torezolid phosphate DONG-A PHARM. CO., LTD. (KR) 2010-10-19 US disclosed
US-20090192197-A1 Antibiotics with improved solubility, lower toxicity; potent antibacterial activity; includes Torezolid phosphate DONG-A PHARM. CO., LTD. (KR) 2009-07-30 US disclosed
EP-1699784-A4 NOVEL OXAZOLIDINONE DERIVATIVES DONG A PHARM CO LTD (KR) 2008-09-03 EP disclosed
US-20070155798-A1 Antibiotics with improved solubility, lower toxicity; potent antibacterial activity; includes torezolid phosphate DONG-A PHARM. CO., LTD. 2007-07-05 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 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-20170049763-A1 NOVEL OXAZOLIDINONE DERIVATIVES ALPI, OXA1L, SI MAOA 2505/4885CYP3A4 46/4885CYP2D6 94/4885
US-20210121449-A1 NOVEL OXAZOLIDINONE DERIVATIVES ALPI, OXA1L, SI MAOA 2505/4885CYP3A4 46/4885CYP2D6 94/4885
US-20070155798-A1 Antibiotics with improved solubility, lower toxicity; potent antibacterial activity; includes torezolid phosphate ALPI, SI, TST MAOA 4398/4885CYP3A4 68/4885CYP2D6 858/4885
US-20200078345-A1 NOVEL OXAZOLIDINONE DERIVATIVES ALPI, OXA1L, SI MAOA 2505/4885CYP3A4 46/4885CYP2D6 94/4885
US-20090192197-A1 Antibiotics with improved solubility, lower toxicity; potent antibacterial activity; includes Torezolid phosphate ALPI, TPI1, SI MAOA 3819/4885CYP3A4 93/4885CYP2D6 460/4885
US-20170333414-A1 NOVEL OXAZOLIDINONE DERIVATIVES ALPI, OXA1L, SI MAOA 2505/4885CYP3A4 46/4885CYP2D6 94/4885
US-20140350059-A1 NOVEL OXAZOLIDINONE DERIVATIVES ALPI, OXA1L, SI MAOA 2505/4885CYP3A4 46/4885CYP2D6 94/4885
US-20180344716-A1 NOVEL OXAZOLIDINONE DERIVATIVES ALPI, OXA1L, SI MAOA 2505/4885CYP3A4 46/4885CYP2D6 94/4885

“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.