Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL69693

Brc1ccccc1OC1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.51
HTR1A P08908 2/20 0.48
SLC6A2 P23975 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KCNH2 Q12809 1/20 0.43
SCN5A Q14524 1/20 0.43
KDM1A O60341 1/20 0.41
HSP90AB1 P08238 1/20 0.41
TOP2A P11388 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
SCHEMBL82594 0.85 HRH1 (0.62) HRH1HTR1ASLC6A2SLC6A3
Hydrochloric Acid SCHEMBL3142742 0.84 HRH1 (0.60) HRH1HTR1ASLC6A2SLC6A3HSP90AB1
Trifluoroacetic Acid SCHEMBL69823 0.84 HRH1 (0.51) HRH1HTR1ASLC6A2SLC6A3
Trifluoroacetic Acid SCHEMBL71491 0.82 SCD (0.44)
Trifluoroacetic Acid SCHEMBL5318468 0.77 GPR6 (0.50) HRH1HTR1ASLC6A2SLC6A3
SCHEMBL13234940 0.76 HTR1A (0.59) HRH1HTR1ASLC6A2SLC6A3
SCHEMBL1927075 0.76 HTR1A (0.59) HRH1HTR1ASLC6A2SLC6A3
Hydrochloric Acid SCHEMBL2944657 0.75 HTR1A (0.57) HRH1HTR1ASLC6A2SLC6A3HSP90AB1
Hydrochloric Acid SCHEMBL2944236 0.75 HTR1A (0.57) HRH1HTR1ASLC6A2SLC6A3HSP90AB1
SCHEMBL69694 0.75 SCD (0.44)

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-8129376-B2 Piperidine derivatives as inhibitors of stearoyl-CoA desaturase AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2012-03-06 US disclosed
EP-2268143-A2 NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE Forest Laboratories Holdings Limited (BM) 2011-01-05 EP disclosed
WO-2009117676-A2 NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 WO disclosed
US-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-09-24 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-20090239810-A1 NOVEL PIPERAZINE DERIVATIVES AS INHIBITORS OF STEAROYL-CoA DESATURASE SCD, SCD5, FADS2 HRH1 3572/4885HTR1A 4153/4885SLC6A2 4356/4885

“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.