Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL719783

Clc1ccc2cc3c(cc2n1)CCNCC3.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.39
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
BACE1 P56817 1/20 0.35
DRD2 P14416 1/20 0.34
ADCY6 O43306 1/20 0.33
ADCY3 O60266 1/20 0.33
ADCY9 O60503 1/20 0.33
ADCY5 O95622 1/20 0.33
ADCY8 P40145 1/20 0.33
ADCY7 P51828 1/20 0.33
ADCY2 Q08462 1/20 0.33
ADCY1 Q08828 1/20 0.33
ADCY4 Q8NFM4 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
SCHEMBL718662 0.86 HTR2C (0.47) HTR2AHTR2CHTR2BDRD2ADCY6
Trifluoroacetic Acid SCHEMBL719124 0.84 PTPN1 (0.40) KDM1ADRD2
Trifluoroacetic Acid SCHEMBL722173 0.82 ALDH1A1 (0.40) KDM1AHTR2AHTR2CHTR2BDRD2
Trifluoroacetic Acid SCHEMBL720167 0.81 KDM1A (0.39) KDM1AHTR2AHTR2CHTR2B
SCHEMBL722817 0.76 ESR1 (0.51) DRD2
Trifluoroacetic Acid SCHEMBL4915477 0.73 DRD2 (0.59) KDM1AHTR2AHTR2CHTR2BDRD2
Trifluoroacetic Acid SCHEMBL722169 0.72 AR (0.38) KDM1AADCY6ADCY3ADCY9ADCY5
Trifluoroacetic Acid SCHEMBL15282793 0.71 HTR2C (0.44) KDM1AHTR2CHTR2B
Trifluoroacetic Acid SCHEMBL5451230 0.70 HTR2C (0.61) KDM1AHTR2AHTR2CHTR2BDRD2
Trifluoroacetic Acid SCHEMBL718879 0.69 PDGFRB (0.36) KDM1AHTR2BDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053168-A1 FUSED BENZOAZEPINES AS NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS TARGACEPT, INC. (US) 2012-03-01 US disclosed
WO-2010096384-A2 FUSED BENZAZEPINES AS NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS TARGACEPT, INC. (US) 2010-08-26 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-20120053168-A1 FUSED BENZOAZEPINES AS NEURONAL NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA2, CHRNA5, CHRNA10 KDM1A 2596/4885HTR2A 311/4885HTR2C 253/4885

“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.