Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4508314

O=C(Nc1cnn(CC(F)(F)F)c1)c1cc(COc2ccccc2Cl)ccn1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MRGPRX4 Q96LA9 2/20 0.44
SCD O00767 11/20 0.43
SCD5 Q86SK9 10/20 0.41
KDR P35968 1/20 0.40
HPGD P15428 2/20 0.40
SLC12A2 P55011 1/20 0.40
SLC12A5 Q9H2X9 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 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
Trifluoroacetic Acid SCHEMBL4504473 0.88 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1MRGPRX4SCDSCD5
SCHEMBL4505284 0.87 ALDH1A1 (0.66) SMN1; SMN2ALDH1A1SCDSCD5
Hydrochloric Acid SCHEMBL4508956 0.86 SCD5 (0.52) SMN1; SMN2ALDH1A1MRGPRX4SCDSCD5
SCHEMBL4493419 0.84 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1SCDSCD5HPGD
SCHEMBL4501251 0.83 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1MRGPRX4SCDSCD5
Hydrochloric Acid SCHEMBL4512405 0.83 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1SCDSCD5HPGD
SCHEMBL4507518 0.83 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1SCDSCD5HPGD
SCHEMBL4507671 0.83 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1SCDSCD5KMT2A
SCHEMBL23241871 0.82 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1SCDSCD5HPGD
SCHEMBL4504477 0.82 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1MRGPRX4SCDSCD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325956-A1 Aromatic amine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-31 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-20090325956-A1 Aromatic amine derivative and use thereof SCD, SCD5, SMS SMN1; SMN2 2075/4885ALDH1A1 1311/4885MRGPRX4 1550/4885

“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.