Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29699564

CC(O)c1cnc2cc[nH]c2n1.O=C(O)C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 1/20 0.34
JAK1 P23458 8/20 0.33
JAK3 P52333 4/20 0.33
TYK2 P29597 2/20 0.33
MAPK1 P28482 4/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
JAK2 O60674 3/20 0.32
S1PR4 O95977 1/20 0.31
S1PR1 P21453 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL20874821 0.87 MAPK1 (0.41) CDK8JAK1JAK3TYK2MAPK1
SCHEMBL25523673 0.75 MAPK1 (0.44) CDK8MAPK1
Trifluoroacetic Acid SCHEMBL27742026 0.68 KIT (0.37) CDK8HRH4HRH3
Trifluoroacetic Acid SCHEMBL28780341 0.66 RIPK1 (0.40) CDK8JAK3MAPK1HRH4HRH3
Trifluoroacetic Acid SCHEMBL4751915 0.64 RIPK1 (0.48) CDK8JAK2
Trifluoroacetic Acid SCHEMBL30978135 0.63 ADRB1 (0.50) NPSR1HRH3
SCHEMBL29699518 0.63 MAPK1 (0.48) CDK8MAPK1
SCHEMBL10141177 0.63 MAPK1 (0.48) JAK1MAPK1JAK2
SCHEMBL12847281 0.63 MAPK1 (0.71) CDK8MAPK1
SCHEMBL2611061 0.62 MAPK1 (0.55) CDK8JAK1JAK3MAPK1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3450436-B1 CONDENSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2022-07-27 EP disclosed
US-11390634-B2 Fused heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-07-19 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 (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-11390634-B2 Fused heterocyclic compound REN, BRD4, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 CDK8 143/4885JAK1 1193/4885JAK3 1695/4885

“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.