Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3544769

Cc1ccc(Sc2ccc(Cl)cc2)c(C2CCNCC2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.47
HTR3A P46098 5/20 0.47
SHMT1 P34896 1/20 0.40
SHMT2 P34897 1/20 0.40
KDM1A O60341 2/20 0.38
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
RHEB Q15382 2/20 0.36
PRCP P42785 1/20 0.35
CYP2C9 P11712 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL3541831 0.89 HTR1A (0.56) HTR1AHTR3ASLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL3548477 0.85 P2RY14 (0.43) HTR1AHTR3AKDM1ASLC6A2SLC6A4
Oxalic Acid SCHEMBL3547675 0.84 HTR1A (0.46) HTR1AHTR3ASLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL5744789 0.83 HTR1A (0.44) HTR1AHTR3AKDM1ASLC6A2SLC6A4
Trifluoroacetic Acid SCHEMBL5743104 0.82 SLC6A2 (0.39) HTR1AHTR3ASHMT1SHMT2KDM1A
SCHEMBL3544140 0.81 HTR1A (0.52) HTR1AHTR3ASLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL5742409 0.81 HTR1A (0.42) HTR1AHTR3ASHMT1SHMT2KDM1A
Trifluoroacetic Acid SCHEMBL5742626 0.81 SLC6A2 (0.42) HTR1AHTR3AKDM1ASLC6A2SLC6A4
Oxalic Acid SCHEMBL3544184 0.80 MAPK14 (0.41) HTR1AHTR3ASLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL3543680 0.80 SLC6A2 (0.43) HTR1AHTR3AKDM1ASLC6A2SLC6A4

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-7732463-B2 4-(2-phenylsulfanyl-phenyl)-piperidine derivatives as serotonin reuptake inhibitors H. LUNDBECK A/S (DK) 2010-06-08 US disclosed
US-20060100242-A1 such as 4-[2-(4-Chloro-phenylsulfanyl)-5-trifluoromethyl-phenyl]-piperidine, used as antidepressants and anxiolytic agents; treatment of panic and obsessive compulsive disorders H.LUNDBECK A/S (DK) 2006-05-11 US disclosed
EP-1626720-A1 4-(2-PHENYLSULFANYL-PHENYL)-PIPERIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS H. Lundbeck A/S (DK) 2006-02-22 EP disclosed
WO-2004087156-A1 4-(2-PHENYLSULFANYL-PHENYL)-PIPERIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS H. LUNDBECK A/S (DK) 2004-10-14 WO 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-20060100242-A1 such as 4-[2-(4-Chloro-phenylsulfanyl)-5-trifluoromethyl-phenyl]-piperidine, used as antidepressants and anxiolytic agents; treatment of panic and obsessive compulsive disorders HTR4, HTR5A, TPH1 HTR1A 11/4885HTR3A 22/4885SHMT1 4726/4885

“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.