Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1921476

COc1ccc(CN2CCC(N)CC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.55
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ACHE P22303 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
CHRM2 P08172 1/20 0.49
CHRM3 P20309 1/20 0.49

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
Trifluoroacetic Acid SCHEMBL1920777 0.88 BCHE (0.56) ACHECHRM2
SCHEMBL8101249 0.87 SIGMAR1 (0.63) SIGMAR1MEN1KMT2AACHE
SCHEMBL1586714 0.87 SIGMAR1 (0.63) SIGMAR1MEN1KMT2AACHE
Hydrochloric Acid SCHEMBL11534460 0.85 SIGMAR1 (0.61) SIGMAR1MEN1KMT2AACHE
Trifluoroacetic Acid SCHEMBL1920766 0.84 SIGMAR1 (0.53) SIGMAR1
Trifluoroacetic Acid SCHEMBL1920595 0.84 ARG1 (0.52) SIGMAR1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL1921350 0.79 MCHR1 (0.58) SIGMAR1KMT2AACHE
SCHEMBL6990156 0.79 S1PR5 (0.67) SIGMAR1MEN1KMT2AHRH3
SCHEMBL11452801 0.78 SIGMAR1 (0.55) SIGMAR1MEN1KMT2A
SCHEMBL28603694 0.78 SIGMAR1 (0.55) SIGMAR1MEN1KMT2A

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-1622914-B1 NEW PIPERIDINYLAMINO-THIENO[2,3-D] PYRIMIDINE COMPOUNDS TROVIS PHARMACEUTICALS LLC (US) 2011-06-01 EP disclosed
US-7030240-B2 5-HT receptor antagonist; [1-(2-Fluoro-benzyl)-piperidin-4-yl]-(5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidin-4-yl)-amine; treating vascular disorders, angina, migraine, pulmonary hypertension and systemic hypertension PREDIX PHARMACEUTICALS HOLDINGS, INC. (US) 2006-04-18 US disclosed
US-20040248904-A1 New piperidinylamino-thieno[2,3-d] pyrimidine compounds TROVIS PHARMACEUTICALS, LLC 2004-12-09 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-20040248904-A1 New piperidinylamino-thieno[2,3-d] pyrimidine compounds HTR5A, HTR2C, HTR1A SIGMAR1 1187/4885MEN1 2833/4885KMT2A 3770/4885

“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.