Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1994879

CC1NCCOc2ccc3c(c(Cl)cn3S(=O)(=O)c3cccnc3)c21.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
HTT P42858 5/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HTR6 P50406 2/20 0.32
TSHR P16473 2/20 0.32
USP2 O75604 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
SMYD3 Q9H7B4 1/20 0.30

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
SCHEMBL1995792 0.93 HTR6 (0.36) KDM4EHTTHPGDHTR6TSHR
Trifluoroacetic Acid SCHEMBL1997380 0.92 HTR6 (0.38) HTR6SMN1; SMN2LMNA
Trifluoroacetic Acid SCHEMBL4409732 0.90 HTR6 (0.37) HTR6SMN1; SMN2LMNA
Trifluoroacetic Acid SCHEMBL1998089 0.87 HTR6 (0.39) HTTHTR6NPSR1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL4421387 0.85
SCHEMBL2003639 0.85 HTR6 (0.42) HTR6
Trifluoroacetic Acid SCHEMBL1999647 0.85 HTR6 (0.40) KDM4EHTTALDH1A1HTR6
Trifluoroacetic Acid SCHEMBL1996456 0.84 HTR6 (0.36) KDM4EHTTHPGDHTR6TSHR
Trifluoroacetic Acid SCHEMBL1998907 0.84 ALDH1A1 (0.37) ALDH1A1HTR6TSHR
SCHEMBL2001918 0.80 PKM (0.44) HTTHTR6NPSR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960374-B2 e.g. 2,5-methylene-9-(phenylsulfonyl)-1,2,3,4,5,9-hexahydro[1,5]oxazocino[3,2-e]indole; serotonin receptors antagonist or partial agonist; metabolic diseases, e.g. obesity, insulin resisitance, type 2 diabetes, eating disorders; antidepressant, anxiolytic agent; cosmetics PROXIMAGEN LIMITED (GB) 2011-06-14 US disclosed
US-20080176829-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-07-24 US 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 (1 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-20080176829-A1 Compounds HTR6, HTR1B, HTR1A KDM4E 3829/4885HTT 943/4885ALDH1A1 691/4885

“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.