Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3600531

CC(=O)Nc1ccccc1N.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 12/20 0.54
HDAC3 O15379 9/20 0.54
HDAC2 Q92769 9/20 0.54
MAPK1 P28482 1/20 0.53
PTGS1 P23219 2/20 0.53
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
NCOR2 Q9Y618 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
POLB P06746 1/20 0.47
CYP2C19 P33261 1/20 0.47
HDAC4 P56524 4/20 0.46
HDAC7 Q8WUI4 4/20 0.46
HDAC10 Q969S8 4/20 0.46
HDAC11 Q96DB2 4/20 0.46
HDAC8 Q9BY41 4/20 0.46
HDAC6 Q9UBN7 4/20 0.46
HDAC9 Q9UKV0 4/20 0.46
HDAC5 Q9UQL6 4/20 0.46

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
SCHEMBL463597 0.88 ALDH1A1 (0.61) HDAC1HDAC3HDAC2MAPK1PTGS1
SCHEMBL29904721 0.88 ALDH1A1 (0.61) HDAC1HDAC3HDAC2MAPK1PTGS1
Hydrochloric Acid SCHEMBL11503558 0.86 HDAC1 (0.59) HDAC1HDAC3HDAC2MAPK1PTGS1
Tacedinaline SCHEMBL248074 0.85 HDAC1 (0.66) HDAC1HDAC3HDAC2MAPK1PTGS1
Aniline SCHEMBL22169226 0.84 HDAC1 (0.58) HDAC1HDAC3HDAC2MAPK1ALDH1A1
Trifluoroacetic Acid SCHEMBL3600528 0.81 SIRT2 (0.57) ALDH1A1HPGDNPC1RAB9APOLB
Trifluoroacetic Acid SCHEMBL8887269 0.81 SMN1; SMN2 (0.46) HDAC1HDAC3HDAC2MAPK1ALDH1A1
SCHEMBL3846828 0.79 PTGS1 (0.58) HDAC1HDAC3HDAC2MAPK1PTGS1
Acetanilide SCHEMBL6388813 0.77 NAPRT (0.76) MAPK1ALDH1A1NPC1RAB9APOLB
SCHEMBL12075892 0.77 HDAC1 (0.63) HDAC1HDAC3HDAC2MAPK1PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121612-B1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2014-10-01 EP disclosed
US-8299102-B2 Heteroarylcyclopropanecarboxamides and their use as pharmaceuticals SANOFI (FR) 2012-10-30 US disclosed
US-20100016278-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2010-01-21 US disclosed
EP-2121612-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis (FR) 2009-11-25 EP disclosed
WO-2008080511-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2008-07-10 WO disclosed
EP-1942104-A1 Heteroarylcyclopropanecarboxamides and their use as pharmaceuticals sanofi-aventis (FR) 2008-07-09 EP 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-20100016278-A1 HETEROARYLCYCLOPROPANECARBOXAMIDES AND THEIR USE AS PHARMACEUTICALS PTGIS, TBXAS1, EDNRA HDAC1 1647/4885HDAC3 1361/4885HDAC2 1593/4885

“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.