Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2837554

Cc1nc2ccc(Oc3ccccc3)cc2c2c1CCN2C1CCN(Cc2ccccc2)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 5/20 0.43
CCR5 P51681 3/20 0.41
MCHR1 Q99705 1/20 0.40
CHRM4 P08173 1/20 0.40
BCHE P06276 3/20 0.39
ACHE P22303 3/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL455236 0.93 CCR8 (0.44) CCR8CCR5
SCHEMBL455242 0.81 MEN1 (0.43) BCHEACHE
SCHEMBL457190 0.80 CCR8 (0.49) CCR8ACHE
Hydrochloric Acid SCHEMBL2831212 0.80 MEN1 (0.42) BCHEACHE
Trifluoroacetic Acid SCHEMBL4717787 0.80 MEN1 (0.38)
SCHEMBL456851 0.80 KDM4E (0.44) BCHEACHE
Hydrochloric Acid SCHEMBL2834368 0.80 CCR8 (0.49) CCR8ACHE
SCHEMBL19432972 0.77 KMT2A (0.40) BCHEACHE
Trifluoroacetic Acid SCHEMBL2836950 0.77 KMT2A (0.56) BCHEACHE
Trifluoroacetic Acid SCHEMBL2837152 0.76 KMT2A (0.60) BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170258784-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2017-09-14 US disclosed
US-9694006-B2 Use of pyrroloquinoline compounds to kill clinically latent microorganisms HELPERBY THERAPEUTICS LIMITED (GB) 2017-07-04 US disclosed
EP-1945211-B1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LTD (GB) 2015-10-21 EP disclosed
US-20120231995-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2012-09-13 US disclosed
US-8207187-B2 Use of pyrroloquinoline compounds to kill clinically latent microorganisms HELPERBY THERAPEUTICS LIMITED (GB) 2012-06-26 US disclosed
US-20100093691-A1 TOPICAL FORMULATIONS HELPERBY THERAPEUTICS LIMITED (GB) 2010-04-15 US disclosed
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS HELPERBY THERAPEUTICS LIMITED (GB) 2009-05-28 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 (4 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-20170258784-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL CCR8 2742/4885CCR5 1454/4885MCHR1 1410/4885
US-20090137622-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL CCR8 2742/4885CCR5 1454/4885MCHR1 1410/4885
US-20120231995-A1 USE OF PYRROLOQUINOLINE COMPOUNDS TO KILL CLINICALLY LATENT MICROORGANISMS LPO, ARG1, CTSL CCR8 2742/4885CCR5 1454/4885MCHR1 1410/4885
US-20100093691-A1 TOPICAL FORMULATIONS DPM1, SUCLG1, LSS CCR8 368/4885CCR5 666/4885MCHR1 820/4885

“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.