Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21816637

CN(C)C(=O)CN1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.47
ALDH1A1 P00352 1/20 0.43
CHRM5 P08912 4/20 0.41
CHRM3 P20309 4/20 0.41
PKM P14618 1/20 0.37
HRH4 Q9H3N8 2/20 0.35
CHRM2 P08172 2/20 0.34
CHRM4 P08173 2/20 0.34
CHRM1 P11229 2/20 0.34
SLC2A1 P11166 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33

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
SCHEMBL5863 0.88 SIGMAR1 (0.56) SIGMAR1ALDH1A1CHRM5CHRM3KDM4E
Hydrochloric Acid SCHEMBL963162 0.86 ALDH1A1 (0.54) SIGMAR1ALDH1A1CHRM5CHRM3DRD2
Piperazine SCHEMBL28845954 0.86 SIGMAR1 (0.54) SIGMAR1ALDH1A1CHRM5CHRM3DRD2
Hydrochloric Acid SCHEMBL17271878 0.86 ALDH1A1 (0.54) SIGMAR1ALDH1A1CHRM5CHRM3DRD2
SCHEMBL2011012 0.81 SIGMAR1 (0.64) SIGMAR1ALDH1A1CHRM5CHRM3CHRM2
Trifluoroacetic Acid SCHEMBL6897031 0.81 SIGMAR1 (0.44) SIGMAR1CHRM5CHRM3PKMHRH4
Hydrochloric Acid SCHEMBL2009563 0.80 SIGMAR1 (0.62) SIGMAR1ALDH1A1CHRM5CHRM3CHRM2
Trifluoroacetic Acid SCHEMBL28555170 0.78 KDM4E (0.44) SIGMAR1CHRM5CHRM3PKMHRH4
Trifluoroacetic Acid SCHEMBL3809378 0.77 ALDH1A1 (0.39) SIGMAR1ALDH1A1CHRM5CHRM3PKM
Trifluoroacetic Acid SCHEMBL6474887 0.75 SIGMAR1 (0.54) SIGMAR1ALDH1A1CHRM5CHRM3HRH4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3640248-B1 AMINOPYRIMIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING ADAMADLE BIOTECHNOLOGY LLC (CN) 2023-08-23 EP disclosed
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof Beijing Adamadle Biotechnology Limited Liability Company (CN) 2022-06-07 US disclosed
EP-3640248-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-04-22 EP disclosed
US-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Beijing Adamadle Biotechnology Limited Liability Company (CN) 2020-03-19 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-20200087296-A1 AMINOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, WEE2, EGFR SIGMAR1 3778/4885ALDH1A1 1646/4885CHRM5 4849/4885
US-11352352-B2 Aminopyrimidine compound, preparation method therefor and use thereof WEE1, WEE2, EGFR SIGMAR1 3778/4885ALDH1A1 1646/4885CHRM5 4849/4885

“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.