Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4640607

COc1cc(NS(C)(=O)=O)ccc1CN.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CYP17A1 P05093 3/20 0.44
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
PLA2G4A P47712 1/20 0.42
CYP2C19 P33261 1/20 0.42
EPHX2 P34913 7/20 0.42
NR1H4 Q96RI1 4/20 0.42
ADRA2C P18825 2/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
GLA P06280 2/20 0.41
SLC22A1 O15245 1/20 0.41
ABCC4 O15439 1/20 0.41
KDM1A O60341 1/20 0.41
NR1I2 O75469 1/20 0.41
TP53 P04637 1/20 0.41

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 SCHEMBL4887236 0.76 KDM4E (0.53) KDM4ELMNASMN1; SMN2EPHX2NR1H4
Trifluoroacetic Acid SCHEMBL5315234 0.76 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1KMT2A
Trifluoroacetic Acid SCHEMBL2480625 0.74 HTR6 (0.55) SMN1; SMN2ADRA2CADRA1AADRA1BDRD2
SCHEMBL3778179 0.72 ADRA2C (0.47) KDM4ELMNAMAPTSMN1; SMN2CYP17A1
SCHEMBL5359155 0.72 ALDH1A1 (0.53) KDM4ELMNAMAPTSMN1; SMN2CYP17A1
SCHEMBL3788443 0.71 ADRA2C (0.56) KDM4ELMNASMN1; SMN2EPHX2NR1H4
SCHEMBL12970664 0.71 MEN1 (0.52) LMNASMN1; SMN2CYP17A1CYP1A2CYP2C9
SCHEMBL12017964 0.70 SMN1; SMN2 (0.67) LMNASMN1; SMN2CYP17A1CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL3778982 0.70 ADRA2C (0.55) KDM4ELMNAMAPTSMN1; SMN2EPHX2
SCHEMBL11570669 0.70 KMT2A (0.49) KDM4ELMNAMAPTSMN1; SMN2CYP17A1

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-1824837-B1 SUBSTITUTED N-SULFONYLAMINOBENZYL-2-PHENOXY ACETAMIDE COMPOUNDS PFIZER (US) 2008-08-13 EP disclosed
US-7214824-B2 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists PFIZER INC. (US) 2007-05-08 US disclosed
US-20060100460-A1 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists PFIZER, INC. 2006-05-11 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-20060100460-A1 Substituted N-sulfonylaminobenzyl-2-phenoxyacetamide compounds as VR1 receptor agonists CNR1, AVPR1A, OPRL1 KDM4E 4801/4885LMNA 2299/4885MAPT 4719/4885

“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.