Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4765400

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1cn(-c2ccccc2)nc1-c1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AURKA O14965 10/20 0.52
TP53 P04637 1/20 0.52
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
MAPT P10636 4/20 0.51
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 3/20 0.51
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KDM5B Q9UGL1 1/20 0.48
RAB9A P51151 1/20 0.47
HPGD P15428 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL4771087 0.95 AURKA (0.58) AURKATP53MEN1KMT2AMAPT
Trifluoroacetic Acid SCHEMBL4771910 0.91 AURKA (0.52) AURKATP53MEN1KMT2AMAPT
SCHEMBL4773081 0.86 AURKA (0.56) AURKATP53MEN1KMT2AMAPT
Trifluoroacetic Acid SCHEMBL4765546 0.83 MEN1 (0.53) TP53MEN1KMT2AMAPTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL4765255 0.82 SLC2A1 (0.43) TP53ALDH1A1LMNASMN1; SMN2RAB9A
Trifluoroacetic Acid SCHEMBL4770781 0.80 SLC2A1 (0.42) AURKA
Trifluoroacetic Acid SCHEMBL4765765 0.80 TP53 (0.50) TP53MEN1KMT2AMAPTLMNA
Trifluoroacetic Acid SCHEMBL4774158 0.78 TMPRSS2 (0.55) TP53MEN1KMT2AMAPTALDH1A1
Trifluoroacetic Acid SCHEMBL4775487 0.78 KMT2A (0.53) MEN1KMT2AALDH1A1KDM4ELMNA
Trifluoroacetic Acid SCHEMBL4774586 0.78 MAPT (0.51) KMT2AMAPTALDH1A1LMNASMN1; SMN2

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
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP claimed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US claimed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP 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-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists HRH3, HRH4, HRH1 AURKA 1133/4885TP53 4863/4885MEN1 2213/4885

“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.