Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3189348

O=C(O)C(F)(F)F.c1cc2cc(-c3ccc(O[C@H]4CN5CCC4CC5)nn3)ccc2s1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.57
KCNH2 Q12809 1/20 0.40
NTMT1 Q9BV86 5/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
UGCG Q16739 1/20 0.35
CSNK2A1 P68400 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
SCHEMBL3190613 0.91 CHRNA7 (0.67) CHRNA7KCNH2CHRNB4CHRNA3HTR3A
Trifluoroacetic Acid SCHEMBL3182857 0.85 CHRNA7 (0.61) CHRNA7
Trifluoroacetic Acid SCHEMBL3183006 0.82 CHRNA7 (0.57) CHRNA7KCNH2HTR3EHTR3BCHRNB4
Trifluoroacetic Acid SCHEMBL3187879 0.82 CHRNA7 (0.72) CHRNA7KCNH2CHRNB4CHRNA3HTR3A
Trifluoroacetic Acid SCHEMBL1542595 0.82 CHRNA7 (0.56) CHRNA7NTMT1HTR3EHTR3BHTR3A
Trifluoroacetic Acid SCHEMBL3187996 0.82 CHRNA7 (0.64) CHRNA7CHRNB4CHRNA3HTR3A
Trifluoroacetic Acid SCHEMBL3190816 0.81 CHRNA7 (0.55) CHRNA7NTMT1
Trifluoroacetic Acid SCHEMBL3180075 0.81 CHRNA7 (0.62) CHRNA7KCNH2NTMT1CHRNB4CHRNA3
Trifluoroacetic Acid SCHEMBL1542199 0.80 CHRNA7 (0.61) CHRNA7HTR3EHTR3BCHRNB4CHRNA3
Trifluoroacetic Acid SCHEMBL3179410 0.80 CHRNA7 (0.54) CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7655657-B2 Fused bicycloheterocycle substituted quinuclidine derivatives ABBOTT LABORATORIES (US) 2010-02-02 US disclosed
US-20080064703-A1 Fused bicycloheterocycle substituted quinuclidine derivatives ABBVIE INC. 2008-03-13 US disclosed
US-20070060588-A1 Fused bicycloheterocycle substituted quinuclidine derivatives ABBOTT LABORATORIES 2007-03-15 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 (2 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-20070060588-A1 Fused bicycloheterocycle substituted quinuclidine derivatives CHRNA1, CHRNA7, CHRNA2 CHRNA7 2/4885KCNH2 197/4885NTMT1 1824/4885
US-20080064703-A1 Fused bicycloheterocycle substituted quinuclidine derivatives IDO1, IDO2, HTR3C CHRNA7 144/4885KCNH2 26/4885NTMT1 2927/4885

“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.