Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5446287

CCOc1ccccc1CN1CCC2(CC1)CCN(C(=O)c1ccc(SC)cc1OC)CC2.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.57
CHRM2 P08172 1/20 0.56
CHRM3 P20309 1/20 0.56
TSHR P16473 4/20 0.56
USP2 O75604 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CYP2D6 P10635 8/20 0.52
CYP3A4 P08684 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 2/20 0.49
CCR8 P51685 4/20 0.49
KCNH2 Q12809 4/20 0.49
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL5402137 0.95 GAA (0.60) GAACHRM2CHRM3TSHRUSP2
Trifluoroacetic Acid SCHEMBL5433995 0.92 GAA (0.60) GAACHRM2CHRM3TSHRUSP2
SCHEMBL5405033 0.88 GAA (0.65) GAACHRM2CHRM3TSHRUSP2
Trifluoroacetic Acid SCHEMBL5446116 0.87 CCR8 (0.52) GAATSHRUSP2SMN1; SMN2CYP2D6
SCHEMBL5446289 0.86 GAA (0.48) GAACHRM2CHRM3TSHRUSP2
Trifluoroacetic Acid SCHEMBL5426050 0.84 CHRM2 (0.60) GAACHRM2CHRM3TSHRUSP2
Trifluoroacetic Acid SCHEMBL5434111 0.82 TSHR (0.65) CHRM2CHRM3TSHRUSP2SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5431377 0.82 CHRM2 (0.59) CHRM2CHRM3TSHRUSP2SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5431336 0.82 CCR8 (0.62) CHRM2CHRM3TSHRUSP2SMN1; SMN2
SCHEMBL5409231 0.81 CCR8 (0.56) GAATSHRUSP2SMN1; SMN2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249648-A1 Novel Diazaspiroalkanes and Their Use for Treatment of Ccr8 Mediated Diseases ASTRAZENECA AB (SE) 2007-10-25 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-20070249648-A1 Novel Diazaspiroalkanes and Their Use for Treatment of Ccr8 Mediated Diseases CCR8, CCR1, CCR10 GAA 2459/4885CHRM2 581/4885CHRM3 312/4885

“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.