Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL507300

Clc1ccc(CSc2c(Cl)ccc3c2CCNCC3)cc1Cl.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPRG P23470 5/20 0.42
PTPRC P08575 5/20 0.41
MAPT P10636 1/20 0.41
HTR2A P28223 3/20 0.39
HTR2C P28335 3/20 0.39
HTR2B P41595 3/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
HIF1A Q16665 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
GFER P55789 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM1A O60341 2/20 0.36
DAO P14920 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34

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 SCHEMBL10476310 0.91 HTR2C (0.41) PTPRGPTPRCMAPTHTR2AHTR2C
Trifluoroacetic Acid SCHEMBL10476317 0.90 HTR2C (0.40) PTPRGHTR2AHTR2CHTR2BHTT
Trifluoroacetic Acid SCHEMBL507111 0.89 HTR2C (0.39) MAPTHTR2AHTR2CHTR2BCYP2D6
SCHEMBL10228938 0.89 HTR2A (0.49) PTPRGMAPTHTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL10476208 0.89 PTPRC (0.40) PTPRGPTPRCHTR2AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL10476275 0.88 HTR2C (0.39) HTR2AHTR2CHTR2BKDM1A
Trifluoroacetic Acid SCHEMBL10476114 0.88 GFER (0.38) MAPTHTR2AHTR2CHTR2BGFER
Trifluoroacetic Acid SCHEMBL10476266 0.88 HTR2C (0.39) HTR2AHTR2CHTR2BKDM1A
Trifluoroacetic Acid SCHEMBL10476313 0.87 HTR2C (0.39) MAPTHTR2AHTR2CHTR2BHTT
Trifluoroacetic Acid SCHEMBL10476135 0.85 EPHX1 (0.41) HTR2AHTR2CHTR2BKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580780-B2 6 substituted 2, 3,4,5 tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonist ELI LILLY AND COMPANY (US) 2013-11-12 US disclosed
EP-2479168-A1 6-Substituted 2,3,4,5-Tetrahydro-1H-Benzo [d]Azepines as 5-HT2C Receptor Agonists ELI LILLY AND COMPANY (US) 2012-07-25 EP disclosed
US-20120028961-A1 6 Substituted 2, 3,4,5 Tetrahydro-1H-Benzo[d]Azepines as 5-HT2c Receptor Agonist ELI LILLY AND COMPANY (US) 2012-02-02 US disclosed
US-8022062-B2 6-substituted 2,3,4,5-tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonists ELI LILLY AND COMPANY (US) 2011-09-20 US disclosed
US-20090099155-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS ARRAY BIOPHARMA, INC. 2009-04-16 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 (2 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-20090099155-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS HTR2C, HTR5A, HTR4 PTPRG 3919/4885PTPRC 2771/4885MAPT 4341/4885
US-20120028961-A1 6 Substituted 2, 3,4,5 Tetrahydro-1H-Benzo[d]Azepines as 5-HT2c Receptor Agonist HTR2C, HTR4, HTR1A PTPRG 3012/4885PTPRC 2451/4885MAPT 4526/4885

“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.