Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2423239

CC1CCCN1C1CCN(c2ccc(NC(=O)c3ccccc3F)cc2)C1.O=C(O)C(F)(F)F

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.68
KCNH2 Q12809 4/20 0.68
NPC1 O15118 1/20 0.55
ALDH1A1 P00352 1/20 0.55
TP53 P04637 1/20 0.55
MAPT P10636 1/20 0.55
RAB9A P51151 1/20 0.55
MCL1 Q07820 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL2421439 0.94 HRH3 (0.75) HRH3KCNH2NPC1ALDH1A1TP53
Trifluoroacetic Acid SCHEMBL2422122 0.89 HRH3 (0.61) HRH3KCNH2
Trifluoroacetic Acid SCHEMBL2421959 0.87 HRH3 (0.63) HRH3KCNH2
Trifluoroacetic Acid SCHEMBL2992354 0.86 HRH3 (0.59) HRH3KCNH2RAB9A
Trifluoroacetic Acid SCHEMBL2422894 0.86 HRH3 (0.74) HRH3KCNH2TP53
Trifluoroacetic Acid SCHEMBL2423337 0.85 HRH3 (0.65) HRH3KCNH2NPC1TP53MAPT
Trifluoroacetic Acid SCHEMBL2424041 0.85 HRH3 (0.72) HRH3KCNH2
Trifluoroacetic Acid SCHEMBL2425342 0.84 HRH3 (0.61) HRH3KCNH2ALDH1A1MAPTMCL1
Trifluoroacetic Acid SCHEMBL2421036 0.84 HRH3 (0.62) HRH3KCNH2NPC1ALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL223740 0.84 HRH3 (0.65) HRH3KCNH2

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 1/4885KCNH2 1508/4885NPC1 1047/4885

“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.