Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2369816

O=C(NCCCSc1c(Cl)ccc2c1CCNCC2)c1ccc(C(F)(F)F)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
EPHX2 P34913 1/20 0.38
RHOC P08134 2/20 0.35
RHOA P61586 2/20 0.35
KMT2A Q03164 2/20 0.34
MRGPRX4 Q96LA9 2/20 0.34
SLC6A3 Q01959 1/20 0.34
NLRP3 Q96P20 1/20 0.34
DPP4 P27487 2/20 0.34
MLYCD O95822 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
CHRM4 P08173 1/20 0.34
CD274 Q9NZQ7 1/20 0.33

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
SCHEMBL10229247 0.96 NAMPT (0.41) NAMPTTMEM97SIGMAR1EPHX2RHOC
Trifluoroacetic Acid SCHEMBL507037 0.93 RAB9A (0.40) TMEM97SIGMAR1EPHX2KMT2AMLYCD
Trifluoroacetic Acid SCHEMBL507752 0.93 KMT2A (0.37) NAMPTKMT2AMLYCDMEN1GAA
SCHEMBL10229258 0.87 RAB9A (0.44) TMEM97SIGMAR1EPHX2KMT2AMEN1
SCHEMBL10229243 0.87 KMT2A (0.41) NAMPTTMEM97SIGMAR1KMT2A
Trifluoroacetic Acid SCHEMBL507959 0.86 RAB9A (0.36) EPHX2KMT2AMEN1LMNAMAPT
Trifluoroacetic Acid SCHEMBL506658 0.82 PKM (0.38) KMT2ASLC6A3MEN1LMNAHTT
SCHEMBL10476325 0.80 LSS (0.43) NAMPTEPHX2KMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL507842 0.79 LSS (0.43) NAMPTEPHX2KMT2AMEN1
SCHEMBL2369820 0.79 MRGPRX4 (0.34) NAMPTTMEM97SIGMAR1EPHX2RHOC

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-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-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 (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-20090099155-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS HTR2C, HTR5A, HTR4 NAMPT 3730/4885TMEM97 321/4885SIGMAR1 225/4885

“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.