Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6282990

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.c1cnc2nc(SCCCN3CCNCC3)oc2c1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 4/20 0.48
TP53 P04637 2/20 0.43
LMNA P02545 3/20 0.41
POLB P06746 1/20 0.41
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
SHMT2 P34897 3/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 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 SCHEMBL6279616 0.94 SOAT1 (0.54) SOAT1TP53LMNAPOLBSHMT2
Trifluoroacetic Acid SCHEMBL6280105 0.85 SOAT1 (0.53) SOAT1LMNAPOLBDRD2ALDH1A1
Trifluoroacetic Acid SCHEMBL1705470 0.79 SOAT1 (0.52) SOAT1LMNAPOLBNPC1ALDH1A1
Trifluoroacetic Acid SCHEMBL6282019 0.73 SOAT1 (0.41) SOAT1LMNADRD2DRD3KDM4E
Trifluoroacetic Acid SCHEMBL1704553 0.72 TMEM97 (0.48) SOAT1LMNAKDM4ENPC1ALDH1A1
SCHEMBL6278513 0.71 SOAT1 (0.90) SOAT1
Trifluoroacetic Acid SCHEMBL5623338 0.70 ALDH1A1 (0.40) SOAT1LMNAKDM4ENPC1ALDH1A1
SCHEMBL6282732 0.69 SOAT1 (0.86) SOAT1
SCHEMBL6283820 0.69 SOAT1 (0.91) SOAT1POLB
SCHEMBL8157356 0.68 SOAT1 (0.91) SOAT1TP53LMNAPOLBSHMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969711-B2 Cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2005-11-29 US disclosed
EP-0987254-B1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME KOWA CO (JP) 2004-12-22 EP disclosed
US-20040038987-A1 Novel cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2004-02-26 US disclosed
EP-0987254-A1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2000-03-22 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-20040038987-A1 Novel cyclic diamine compounds and medicine containing the same LCAT, ACAT2, ACAT1 SOAT1 5/4885TP53 4601/4885LMNA 4085/4885

“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.