Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6434797

O=C(O)C(F)(F)F.Oc1ccc(C2CCCC(N3CCNCC3)C2)c(O)c1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.36
SIGMAR1 Q99720 4/20 0.36
TMEM97 Q5BJF2 2/20 0.36
OPRM1 P35372 3/20 0.34
OPRD1 P41143 3/20 0.34
TYR P14679 1/20 0.34
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33

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
SCHEMBL6451400 0.90 CHRNB2 (0.37) SIGMAR1TMEM97HPGDKMT2ASMN1; SMN2
SCHEMBL6434802 0.87 SIGMAR1 (0.35) KDM1ASIGMAR1TMEM97ESR1ESR2
Trifluoroacetic Acid SCHEMBL6434348 0.75 TYR (0.37) KDM1ATYRESR1ESR2
Trifluoroacetic Acid SCHEMBL4071422 0.74 HTR6 (0.43) SIGMAR1HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL1018462 0.74 HTR6 (0.43) SIGMAR1HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL5618525 0.69 HPGD (0.45) HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL3963270 0.68 HTR6 (0.43) SIGMAR1OPRM1OPRD1KMT2A
Trifluoroacetic Acid SCHEMBL29823097 0.67 HPGD (0.40) HPGDKMT2ASMN1; SMN2
Trifluoroacetic Acid SCHEMBL7330887 0.67 KMT2A (0.74) SIGMAR1HPGDKMT2ASMN1; SMN2
SCHEMBL8315420 0.66 QDPR (0.50) TYRHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6933319-B2 Resorcinol derivatives PFIZER INC. (US) 2005-08-23 US disclosed
EP-1165495-B1 RESORCINOL DERIVATIVES PFIZER (US) 2005-04-20 EP disclosed
US-6828460-B2 Containing at least one ester, oxime, sulfonamide, hydroxyamino or alkyoxyamino functionality; skin lightening agents; tyrosinase inhibitors PFIZER INC. 2004-12-07 US disclosed
US-20040209949-A1 Resorcinol derivatives BROWNING ANDREW FRANCIS (SE) 2004-10-21 US disclosed
US-20020161041-A1 Resorcinol derivatives PFIZER INC. 2002-10-31 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 (2 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-20040209949-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 KDM1A 2409/4885SIGMAR1 3938/4885TMEM97 2855/4885
US-20020161041-A1 Resorcinol derivatives NQO1, LRAT, ALDH1A2 KDM1A 2409/4885SIGMAR1 3938/4885TMEM97 2855/4885

“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.