Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4243869

Cc1c(CCc2cccc(-c3ccco3)c2)nc(N)n(C)c1=O.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.42
ADORA2A P29274 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PRMT6 Q96LA8 1/20 0.36
PSMB5 P28074 2/20 0.36
F2 P00734 1/20 0.36
KEAP1 Q14145 1/20 0.35
CMA1 P23946 1/20 0.35
CTRC Q99895 1/20 0.35
CASR P41180 1/20 0.35
ADORA1 P30542 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
SCHEMBL8231282 0.92 BACE1 (0.46) BACE1ADORA2AMEN1KMT2APRMT6
Trifluoroacetic Acid SCHEMBL4250441 0.85 BACE1 (0.57) BACE1CMA1CTRC
Trifluoroacetic Acid SCHEMBL4248535 0.82 MEN1 (0.51) BACE1MEN1KMT2ACASR
Trifluoroacetic Acid SCHEMBL4248393 0.82 BACE1 (0.53) BACE1MEN1KMT2A
SCHEMBL8231287 0.75 BACE1 (0.67) BACE1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL4242063 0.74 KMT2A (0.49) BACE1MEN1KMT2AF2CMA1
Trifluoroacetic Acid SCHEMBL4242602 0.74 BACE1 (0.55) BACE1MEN1KMT2ACMA1CTRC
SCHEMBL4137267 0.74 BACE1 (0.71) BACE1ADORA2APRMT6
SCHEMBL8240375 0.73 MEN1 (0.60) BACE1MEN1KMT2A
SCHEMBL4252260 0.72 BACE1 (0.62) BACE1ADORA2AMEN1KMT2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215801-A9 Novel 2-Aminopyrimidinone Derivatives And Their Use ASTRAZENECA AB, SODERTAIJE, SWEDENASTEX THEREAPEUTICS LTD (GB) 2009-08-27 US claimed
US-20080255164-A1 Novel 2-Aminopyrimidinone Derivatives And Their Use ASTRAZENECA AB (SE) 2008-10-16 US claimed
EP-1951680-A1 NOVEL 2-AMINOPYRIMIDINONE DERIVATIVES AND THEIR USE Astra Zeneca AB (SE) 2008-08-06 EP claimed
WO-2007058580-A1 NOVEL 2-AMINOPYRIMIDINONE DERIVATIVES AND THEIR USE ASTRAZENECA AB (SE) 2007-05-24 WO claimed
US-20090215801-A9 Novel 2-Aminopyrimidinone Derivatives And Their Use ASTRAZENECA AB, SODERTAIJE, SWEDENASTEX THEREAPEUTICS LTD (GB) 2009-08-27 US disclosed
US-20080255164-A1 Novel 2-Aminopyrimidinone Derivatives And Their Use ASTRAZENECA AB (SE) 2008-10-16 US disclosed
EP-1951680-A1 NOVEL 2-AMINOPYRIMIDINONE DERIVATIVES AND THEIR USE Astra Zeneca AB (SE) 2008-08-06 EP disclosed
WO-2007058580-A1 NOVEL 2-AMINOPYRIMIDINONE DERIVATIVES AND THEIR USE ASTRAZENECA AB (SE) 2007-05-24 WO 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-20090215801-A9 Novel 2-Aminopyrimidinone Derivatives And Their Use PSEN2, PSEN1, MAPT BACE1 9/4885ADORA2A 607/4885MEN1 4103/4885
US-20080255164-A1 Novel 2-Aminopyrimidinone Derivatives And Their Use PSEN2, PSEN1, MAPT BACE1 9/4885ADORA2A 607/4885MEN1 4103/4885

“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.