Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2425145

Cc1cc(NC(=O)c2cccc(C(F)(F)F)c2)ccc1N1CCC(N2CCCC2C)C1.O=C(O)C(F)(F)F

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.59
CHRM4 P08173 1/20 0.47
CHRM5 P08912 1/20 0.47
CHRM1 P11229 1/20 0.47
CHRM3 P20309 1/20 0.47
LCK P06239 2/20 0.46
MAPK14 Q16539 2/20 0.46
BTK Q06187 1/20 0.46
RAF1 P04049 5/20 0.46
BRAF P15056 5/20 0.46
TDP1 Q9NUW8 1/20 0.46
ABL1 P00519 1/20 0.45
KIT P10721 1/20 0.45
SRC P12931 1/20 0.45
KCNH2 Q12809 1/20 0.44

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
SCHEMBL2419835 0.97 HRH3 (0.61) HRH3CHRM4CHRM5CHRM1CHRM3
Trifluoroacetic Acid SCHEMBL2421907 0.91 HRH3 (0.59) HRH3TDP1KCNH2
Trifluoroacetic Acid SCHEMBL2421603 0.89 HRH3 (0.64) HRH3TDP1KCNH2
Trifluoroacetic Acid SCHEMBL2420806 0.89 HRH3 (0.57) HRH3BRAFTDP1KCNH2
Trifluoroacetic Acid SCHEMBL2423022 0.89 HRH3 (0.64) HRH3KCNH2
Trifluoroacetic Acid SCHEMBL2421645 0.87 HRH3 (0.58) HRH3KCNH2
SCHEMBL13266071 0.86 HRH3 (0.73) HRH3TDP1KCNH2
Trifluoroacetic Acid SCHEMBL2419125 0.86 HRH3 (0.67) HRH3KCNH2
Trifluoroacetic Acid SCHEMBL2425266 0.86 HRH3 (0.72) HRH3TDP1KCNH2
SCHEMBL2420290 0.86 HRH3 (0.64) HRH3TDP1KCNH2

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-8618159-B2 Substituted N-phenyl-bipyrrolidine carboxamides and therapeutic use thereof SANOFI (FR) 2013-12-31 US disclosed
EP-2212282-B1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2011-09-21 EP disclosed
US-20100173897-A1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-07-08 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-20100173897-A1 SUBSTITUTED N-PHENYL-BIPYRROLIDINE CARBOXAMIDES AND THERAPEUTIC USE THEREOF HRH3, HRH4, CNR1 HRH3 1/4885CHRM4 287/4885CHRM5 223/4885

“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.