Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL15540513

NC(=O)[C@@H]1C[C@@]1(F)c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.49
MAOA P21397 6/20 0.49
HTR2A P28223 2/20 0.41
HTR2C P28335 2/20 0.41
HTR2B P41595 2/20 0.41
KMT2A Q03164 1/20 0.41
KDM1A O60341 4/20 0.37

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 SCHEMBL15542079 1.00 MAOB (0.49) MAOBMAOAHTR2AHTR2CHTR2B
SCHEMBL15540919 0.92 MAOB (0.57) MAOBMAOAHTR2AHTR2CHTR2B
SCHEMBL6427142 0.92 MAOB (0.57) MAOBMAOAHTR2AHTR2CHTR2B
SCHEMBL15542347 0.92 MAOB (0.57) MAOBMAOAHTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL15540515 0.83 MAOB (0.71) MAOBMAOAKDM1A
Trifluoroacetic Acid SCHEMBL15542082 0.83 MAOB (0.71) MAOBMAOAKDM1A
SCHEMBL301325 0.78 MAOB (0.55) MAOBMAOAHTR2AHTR2CHTR2B
SCHEMBL2832287 0.76 MAOB (0.59) MAOBMAOAKMT2AKDM1A
SCHEMBL5998895 0.71 KMT2A (0.62) MAOBMAOAKMT2A
Trifluoroacetic Acid SCHEMBL15540543 0.69 MAOB (0.44) MAOBMAOAKDM1A

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-2867226-B1 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2018-11-14 EP disclosed
EP-2867226-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF Novartis AG (CH) 2015-05-06 EP disclosed
WO-2014002051-A2 COMPLEMENT PATHWAY MODULATORS AND USES THEREOF NOVARTIS AG (CH) 2014-01-03 WO disclosed