Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL9895752

C[C@@](Cc1ccccc1)(NCc1ccc(/C=C/C(=O)NO)cc1)C(=O)OC1CCCC1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 16/20 0.47
HDAC3 O15379 13/20 0.47
HDAC8 Q9BY41 12/20 0.47
HDAC2 Q92769 12/20 0.47
HDAC4 P56524 9/20 0.45
HDAC5 Q9UQL6 7/20 0.45
HDAC6 Q9UBN7 6/20 0.45
MEF2D Q14814 3/20 0.45
HDAC7 Q8WUI4 5/20 0.43
HDAC10 Q969S8 5/20 0.43
HDAC11 Q96DB2 5/20 0.43
HDAC9 Q9UKV0 5/20 0.43
KDM1A O60341 2/20 0.42
MAOA P21397 1/20 0.42
NCOR2 Q9Y618 1/20 0.40
KCNH2 Q12809 2/20 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
SCHEMBL7900455 0.95 HDAC1 (0.51) HDAC1HDAC3HDAC8HDAC2HDAC4
Trifluoroacetic Acid SCHEMBL15378144 0.90 HDAC3 (0.47) HDAC1HDAC3HDAC8HDAC2HDAC4
Trifluoroacetic Acid SCHEMBL9904047 0.88 HDAC3 (0.45) HDAC1HDAC3HDAC8HDAC2HDAC4
Trifluoroacetic Acid SCHEMBL9895157 0.88 HDAC3 (0.45) HDAC1HDAC3HDAC8HDAC2HDAC4
Trifluoroacetic Acid SCHEMBL9895594 0.87 HDAC3 (0.49) HDAC1HDAC3HDAC8HDAC2HDAC4
SCHEMBL7900767 0.84 HDAC3 (0.52) HDAC1HDAC3HDAC8HDAC2HDAC4
SCHEMBL9896193 0.84 HDAC3 (0.52) HDAC1HDAC3HDAC8HDAC2HDAC4
SCHEMBL9896190 0.84 HDAC3 (0.52) HDAC1HDAC3HDAC8HDAC2HDAC4
Trifluoroacetic Acid SCHEMBL9894679 0.84 HDAC3 (0.46) HDAC1HDAC3HDAC8HDAC2HDAC4
SCHEMBL7897836 0.82 HDAC3 (0.49) HDAC1HDAC3HDAC8HDAC2HDAC4

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
US-20140155439-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2014-06-05 US disclosed
US-20130303576-A1 ENZYME INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-11-14 US disclosed
US-20120149736-A1 ENZYME INHIBITORS CHROMA THERAPEUTICS LTD. (GB) 2012-06-14 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 (3 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-20130303576-A1 ENZYME INHIBITORS HDAC1, HDAC4, HDAC3 HDAC1 1/4885HDAC3 3/4885HDAC8 13/4885
US-20140155439-A1 ENZYME INHIBITORS HDAC4, HDAC1, HDAC3 HDAC1 2/4885HDAC3 3/4885HDAC8 11/4885
US-20120149736-A1 ENZYME INHIBITORS HAT1, HDAC1, NAT1 HDAC1 2/4885HDAC3 5/4885HDAC8 10/4885

“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.